BAS 09687664
TL;DR: BAS 09687664 (CAS 824943-97-7) is a chemical compound with molecular formula C15H15N3O3S2 and molecular weight 349.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(5-ethylsulfanyl-1,3,4-thiadiazol-2-yl)-3-methyl-1-oxo-4H-isochromene-3-carboxamide
Also Known As: BAS 09687664, N-(5-ethylsulfanyl-1,3,4-thiadiazol-2-yl)-3-methyl-1-oxo-4H-isochromene-3-carboxamide, N-[5-(ethylthio)-1,3,4-thiadiazol-2-yl]-3-methyl-1-oxo-3,4-dihydro-1H-isochromene-3-carboxamide, N-(5-(ethylthio)-1,3,4-thiadiazol-2-yl)-3-methyl-1-oxoisochroman-3-carboxamide, N-(5-ethylthio(1,3,4-thiadiazol-2-yl))(3-methyl-1-oxoisochroman-3-yl)carboxami de
| Molecular Formula | C15H15N3O3S2 |
|---|---|
| Molecular Weight | 349.06 g/mol |
| LogP | 2.7604 |
| Topological Polar Surface Area | 81.18 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 349.05548 |
| Heavy Atoms | 23 |
| Complexity | 761.9303 |
Chemical Identifiers
| CAS Number | 824943-97-7 |
|---|---|
| SMILES | CCSC1=NN=C(S1)NC(=O)C2(CC3=CC=CC=C3C(=O)O2)C |
Product Overview
BAS 09687664 (CAS 824943-97-7), with molecular formula C15H15N3O3S2 and molecular weight 349.06 g/mol. IUPAC: N-(5-ethylsulfanyl-1,3,4-thiadiazol-2-yl)-3-methyl-1-oxo-4H-isochromene-3-carboxamide.
Chemical Property Profile of BAS 09687664
Property Insights of BAS 09687664
The XLogP value of 2.7604 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 09687664. The TPSA of 81.18 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 09687664. Following Lipinski's Rule of Five, BAS 09687664 has 1 hydrogen bond donor(s) and 7 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 BAS 09687664?
The CAS number of BAS 09687664 is 824943-97-7.
What is the molecular formula of BAS 09687664?
The molecular formula of BAS 09687664 is C15H15N3O3S2.
What is the molecular weight of BAS 09687664?
The molecular weight of BAS 09687664 is 349.06 g/mol.
Where can I buy BAS 09687664?
You can request a quote for BAS 09687664 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 09687664?
Yes, KEHONG BIO provides custom synthesis services for BAS 09687664 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.