![3-(4-chlorophenyl)-6,6-dimethyl-1-(4-nitrobenzyl)-1,5,6,8-tetrahydro-2H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidine-2,4(3H)-dione structure](/static/products/573/573935-65-6.webp)
3-(4-chlorophenyl)-6,6-dimethyl-1-(4-nitrobenzyl)-1,5,6,8-tetrahydro-2H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidine-2,4(3H)-dione
TL;DR: 3-(4-chlorophenyl)-6,6-dimethyl-1-(4-nitrobenzyl)-1,5,6,8-tetrahydro-2H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidine-2,4(3H)-dione (CAS 573935-65-6) is a chemical compound with molecular formula C24H20ClN3O5S and molecular weight 497.0812 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-(4-chlorophenyl)-12,12-dimethyl-6-[(4-nitrophenyl)methyl]-11-oxa-8-thia-4,6-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7)-diene-3,5-dione
Also Known As: 3-(4-chlorophenyl)-6,6-dimethyl-1-(4-nitrobenzyl)-1,5,6,8-tetrahydro-2H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidine-2,4(3H)-dione, 4-(4-Chlorophenyl)-12,12-dimethyl-6-[(4-nitrophenyl)methyl]-11-oxa-8-thia-4,6-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7)-diene-3,5-dione, 3-(4-chlorophenyl)-6,6-dimethyl-1-(4-nitrobenzyl)-5,6-dihydro-1H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidine-2,4(3H,8H)-dione, 3-(4-Chlorophenyl)-6,6-dimethyl-1-[(4-nitrophenyl)methyl]-1,5,6,8-tetrahydro-2H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidine-2,4(3H)-dione
Technical Specifications
| Molecular Formula | C24H20ClN3O5S |
| Molecular Weight | 497.0812 g/mol |
| XLogP | 4.7 |
| Topological Polar Surface Area (TPSA) | 124.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 497.0812 Da |
| Heavy Atoms | 34 |
| Complexity | 822.0 |
| SMILES | CC1(CC2=C(CO1)SC3=C2C(=O)N(C(=O)N3CC4=CC=C(C=C4)[N+](=O)[O-])C5=CC=C(C=C5)Cl)C |
| InChIKey | HXBCHVDBJNYMJG-UHFFFAOYSA-N |
Chemical Property Profile of 3-(4-chlorophenyl)-6,6-dimethyl-1-(4-nitrobenzyl)-1,5,6,8-tetrahydro-2H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidine-2,4(3H)-dione
Property Insights of 3-(4-chlorophenyl)-6,6-dimethyl-1-(4-nitrobenzyl)-1,5,6,8-tetrahydro-2H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidine-2,4(3H)-dione
The XLogP value of 4.7 indicates that 3-(4-chlorophenyl)-6,6-dimethyl-1-(4-nitrobenzyl)-1,5,6,8-tetrahydro-2H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidine-2,4(3H)-dione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 124.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(4-chlorophenyl)-6,6-dimethyl-1-(4-nitrobenzyl)-1,5,6,8-tetrahydro-2H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidine-2,4(3H)-dione. Following Lipinski's Rule of Five, 3-(4-chlorophenyl)-6,6-dimethyl-1-(4-nitrobenzyl)-1,5,6,8-tetrahydro-2H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidine-2,4(3H)-dione has 0 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 3-(4-chlorophenyl)-6,6-dimethyl-1-(4-nitrobenzyl)-1,5,6,8-tetrahydro-2H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidine-2,4(3H)-dione?
The CAS number of 3-(4-chlorophenyl)-6,6-dimethyl-1-(4-nitrobenzyl)-1,5,6,8-tetrahydro-2H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidine-2,4(3H)-dione is 573935-65-6.
What is the molecular formula of 3-(4-chlorophenyl)-6,6-dimethyl-1-(4-nitrobenzyl)-1,5,6,8-tetrahydro-2H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidine-2,4(3H)-dione?
The molecular formula of 3-(4-chlorophenyl)-6,6-dimethyl-1-(4-nitrobenzyl)-1,5,6,8-tetrahydro-2H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidine-2,4(3H)-dione is C24H20ClN3O5S.
What is the molecular weight of 3-(4-chlorophenyl)-6,6-dimethyl-1-(4-nitrobenzyl)-1,5,6,8-tetrahydro-2H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidine-2,4(3H)-dione?
The molecular weight of 3-(4-chlorophenyl)-6,6-dimethyl-1-(4-nitrobenzyl)-1,5,6,8-tetrahydro-2H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidine-2,4(3H)-dione is 497.0812 g/mol.
Where can I buy 3-(4-chlorophenyl)-6,6-dimethyl-1-(4-nitrobenzyl)-1,5,6,8-tetrahydro-2H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidine-2,4(3H)-dione?
You can request a quote for 3-(4-chlorophenyl)-6,6-dimethyl-1-(4-nitrobenzyl)-1,5,6,8-tetrahydro-2H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidine-2,4(3H)-dione directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 3-(4-chlorophenyl)-6,6-dimethyl-1-(4-nitrobenzyl)-1,5,6,8-tetrahydro-2H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidine-2,4(3H)-dione?
Yes, CoreyChem provides custom synthesis services for 3-(4-chlorophenyl)-6,6-dimethyl-1-(4-nitrobenzyl)-1,5,6,8-tetrahydro-2H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidine-2,4(3H)-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.