UPCMLD0ENAT5891514:001
TL;DR: UPCMLD0ENAT5891514:001 (CAS 667913-02-2) is a chemical compound with molecular formula C19H21N3OS3 and molecular weight 403.0847 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
5-[(2-methyl-1,3-thiazol-4-yl)methylsulfanyl]-4-prop-2-enyl-8-thia-4,6-diazatricyclo[7.5.0.02,7]tetradeca-1(9),2(7),5-trien-3-one
Also Known As: UPCMLD0ENAT5891514:001, AQ-750/41791339, 3-allyl-2-(((2-methylthiazol-4-yl)methyl)thio)-6,7,8,9-tetrahydro-3H-cyclohepta[4,5]thieno[2,3-d]pyrimidin-4(5H)-one, F3111-1494, 5-[(2-Methyl-1,3-thiazol-4-yl)methylsulfanyl]-4-prop-2-enyl-8-thia-4,6-diazatricyclo[7.5.0.02,7]tetradeca-1(9),2(7),5-trien-3-one
Technical Specifications
| Molecular Formula | C19H21N3OS3 |
| Molecular Weight | 403.0847 g/mol |
| XLogP | 5.2 |
| Topological Polar Surface Area (TPSA) | 127.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 403.0847 Da |
| Heavy Atoms | 26 |
| Complexity | 584.0 |
| SMILES | CC1=NC(=CS1)CSC2=NC3=C(C4=C(S3)CCCCC4)C(=O)N2CC=C |
| InChIKey | OPCWOZQGKPSMFC-UHFFFAOYSA-N |
Chemical Property Profile of UPCMLD0ENAT5891514:001
Property Insights of UPCMLD0ENAT5891514:001
The XLogP value of 5.2 indicates that UPCMLD0ENAT5891514:001 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 127.0 Ų falls within the moderate polarity range, balancing permeability and solubility for UPCMLD0ENAT5891514:001. Following Lipinski's Rule of Five, UPCMLD0ENAT5891514:001 has 0 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of UPCMLD0ENAT5891514:001?
The CAS number of UPCMLD0ENAT5891514:001 is 667913-02-2.
What is the molecular formula of UPCMLD0ENAT5891514:001?
The molecular formula of UPCMLD0ENAT5891514:001 is C19H21N3OS3.
What is the molecular weight of UPCMLD0ENAT5891514:001?
The molecular weight of UPCMLD0ENAT5891514:001 is 403.0847 g/mol.
Where can I buy UPCMLD0ENAT5891514:001?
You can request a quote for UPCMLD0ENAT5891514:001 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for UPCMLD0ENAT5891514:001?
Yes, CoreyChem provides custom synthesis services for UPCMLD0ENAT5891514:001 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.