AF-399/40771974
TL;DR: AF-399/40771974 (CAS 385373-98-8) is a chemical compound with molecular formula C15H14N2O3S2 and molecular weight 334.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-(3,4-dimethoxyphenyl)-2-oxo-3,5,6,7-tetrahydrothiopyrano[2,3-d][1,3]thiazole-6-carbonitrile
Also Known As: AF-399/40771974, 7-(3,4-dimethoxyphenyl)-2-oxo-3,5,6,7-tetrahydro-2H-thiopyrano[2,3-d][1,3]thiazole-6-carbonitrile, 7-(3,4-dimethoxyphenyl)-2-oxo-3,5,6,7-tetrahydro-2H-thiopyrano[2,3-d]thiazole-6-carbonitrile, 7-(3,4-dimethoxyphenyl)-2-oxo-3,5,6,7-tetrahydrothiopyrano[2,3-d][1,3]thiazole-6-carbonitrile
| Molecular Formula | C15H14N2O3S2 |
|---|---|
| Molecular Weight | 334.04 g/mol |
| LogP | 2.83098 |
| Topological Polar Surface Area | 75.11 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 334.0446 |
| Heavy Atoms | 22 |
| Complexity | 790.81573 |
Chemical Identifiers
| CAS Number | 385373-98-8 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)C2C(CSC3=C2SC(=O)N3)C#N)OC |
Product Overview
AF-399/40771974 (CAS 385373-98-8), with molecular formula C15H14N2O3S2 and molecular weight 334.04 g/mol. IUPAC: 7-(3,4-dimethoxyphenyl)-2-oxo-3,5,6,7-tetrahydrothiopyrano[2,3-d][1,3]thiazole-6-carbonitrile.
Chemical Property Profile of AF-399/40771974
Property Insights of AF-399/40771974
The XLogP value of 2.83098 suggests moderate lipophilicity, balancing water solubility and membrane permeability for AF-399/40771974. The TPSA of 75.11 Ų falls within the moderate polarity range, balancing permeability and solubility for AF-399/40771974. Following Lipinski's Rule of Five, AF-399/40771974 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
Frequently Asked Questions
What is the CAS number of AF-399/40771974?
The CAS number of AF-399/40771974 is 385373-98-8.
What is the molecular formula of AF-399/40771974?
The molecular formula of AF-399/40771974 is C15H14N2O3S2.
What is the molecular weight of AF-399/40771974?
The molecular weight of AF-399/40771974 is 334.04 g/mol.
Where can I buy AF-399/40771974?
You can request a quote for AF-399/40771974 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AF-399/40771974?
Yes, KEHONG BIO provides custom synthesis services for AF-399/40771974 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.