3-Benzenesulfonyl-2-imino-8-methyl-1-(tetrahydro-furan-2-ylmethyl)-1,2-dihydro-1,9,10a-triaza-anthrace n-10-one
TL;DR: 3-Benzenesulfonyl-2-imino-8-methyl-1-(tetrahydro-furan-2-ylmethyl)-1,2-dihydro-1,9,10a-triaza-anthrace n-10-one (CAS 606954-16-9) is a chemical compound with molecular formula C23H22N4O4S and molecular weight 450.13617 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
5-(benzenesulfonyl)-6-imino-11-methyl-7-(oxolan-2-ylmethyl)-1,7,9-triazatricyclo[8.4.0.03,8]tetradeca-3(8),4,9,11,13-pentaen-2-one
Also Known As: 3-Benzenesulfonyl-2-imino-8-methyl-1-(tetrahydro-furan-2-ylmethyl)-1,2-dihydro-1,9,10a-triaza-anthrace n-10-one, 2-imino-10-methyl-3-(phenylsulfonyl)-1-((tetrahydrofuran-2-yl)methyl)-1H-dipyrido[1,2-a:2',3'-d]pyrimidin-5(2H)-one, 3-besyl-2-imino-10-methyl-1-(tetrahydrofurfuryl)dipyrido[3,4-c:1'',2''-f]pyrimidin-5-one, 2-azanylidene-10-methyl-1-(oxolan-2-ylmethyl)-3-(phenylsulfonyl)dipyrido[3,4-c:1'',2''-f]pyrimidin-5-one, 2-imino-10-methyl-3-(phenylsulfonyl)-1-(tetrahydro-2-furanylmethyl)-1,2-dihydro-5H-dipyrido[1,2-a:2,3-d]pyrimidin-5-one
Technical Specifications
| Molecular Formula | C23H22N4O4S |
| Molecular Weight | 450.13617 g/mol |
| XLogP | 1.8 |
| Topological Polar Surface Area (TPSA) | 112.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 450.13617 Da |
| Heavy Atoms | 32 |
| Complexity | 1120.0 |
| SMILES | CC1=CC=CN2C1=NC3=C(C2=O)C=C(C(=N)N3CC4CCCO4)S(=O)(=O)C5=CC=CC=C5 |
| InChIKey | MDRBFUUAYBSUJN-UHFFFAOYSA-N |
Chemical Property Profile of 3-Benzenesulfonyl-2-imino-8-methyl-1-(tetrahydro-furan-2-ylmethyl)-1,2-dihydro-1,9,10a-triaza-anthrace n-10-one
Property Insights of 3-Benzenesulfonyl-2-imino-8-methyl-1-(tetrahydro-furan-2-ylmethyl)-1,2-dihydro-1,9,10a-triaza-anthrace n-10-one
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Benzenesulfonyl-2-imino-8-methyl-1-(tetrahydro-furan-2-ylmethyl)-1,2-dihydro-1,9,10a-triaza-anthrace n-10-one. The TPSA of 112.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-Benzenesulfonyl-2-imino-8-methyl-1-(tetrahydro-furan-2-ylmethyl)-1,2-dihydro-1,9,10a-triaza-anthrace n-10-one. Following Lipinski's Rule of Five, 3-Benzenesulfonyl-2-imino-8-methyl-1-(tetrahydro-furan-2-ylmethyl)-1,2-dihydro-1,9,10a-triaza-anthrace n-10-one has 1 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-Benzenesulfonyl-2-imino-8-methyl-1-(tetrahydro-furan-2-ylmethyl)-1,2-dihydro-1,9,10a-triaza-anthrace n-10-one?
The CAS number of 3-Benzenesulfonyl-2-imino-8-methyl-1-(tetrahydro-furan-2-ylmethyl)-1,2-dihydro-1,9,10a-triaza-anthrace n-10-one is 606954-16-9.
What is the molecular formula of 3-Benzenesulfonyl-2-imino-8-methyl-1-(tetrahydro-furan-2-ylmethyl)-1,2-dihydro-1,9,10a-triaza-anthrace n-10-one?
The molecular formula of 3-Benzenesulfonyl-2-imino-8-methyl-1-(tetrahydro-furan-2-ylmethyl)-1,2-dihydro-1,9,10a-triaza-anthrace n-10-one is C23H22N4O4S.
What is the molecular weight of 3-Benzenesulfonyl-2-imino-8-methyl-1-(tetrahydro-furan-2-ylmethyl)-1,2-dihydro-1,9,10a-triaza-anthrace n-10-one?
The molecular weight of 3-Benzenesulfonyl-2-imino-8-methyl-1-(tetrahydro-furan-2-ylmethyl)-1,2-dihydro-1,9,10a-triaza-anthrace n-10-one is 450.13617 g/mol.
Where can I buy 3-Benzenesulfonyl-2-imino-8-methyl-1-(tetrahydro-furan-2-ylmethyl)-1,2-dihydro-1,9,10a-triaza-anthrace n-10-one?
You can request a quote for 3-Benzenesulfonyl-2-imino-8-methyl-1-(tetrahydro-furan-2-ylmethyl)-1,2-dihydro-1,9,10a-triaza-anthrace n-10-one directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 3-Benzenesulfonyl-2-imino-8-methyl-1-(tetrahydro-furan-2-ylmethyl)-1,2-dihydro-1,9,10a-triaza-anthrace n-10-one?
Yes, CoreyChem provides custom synthesis services for 3-Benzenesulfonyl-2-imino-8-methyl-1-(tetrahydro-furan-2-ylmethyl)-1,2-dihydro-1,9,10a-triaza-anthrace n-10-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.