BAS 01235545
TL;DR: BAS 01235545 (CAS 197570-01-7) is a chemical compound with molecular formula C14H12BrN3O2S and molecular weight 364.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[4-(4-bromophenyl)-5-cyano-2-oxo-3,4-dihydro-1H-pyridin-6-yl]sulfanyl]acetamide
Also Known As: BAS 01235545, AB00076733-01, 2-[[4-(4-bromophenyl)-5-cyano-2-oxo-3,4-dihydro-1H-pyridin-6-yl]sulfanyl]acetamide, 2-{[4-(4-bromophenyl)-3-cyano-6-oxo-1,4,5,6-tetrahydropyridin-2-yl]sulfanyl}acetamide, 2-[4-(4-bromophenyl)-3-cyano-6-oxo-2-1,4,5-trihydropyridylthio]acetamide
| Molecular Formula | C14H12BrN3O2S |
|---|---|
| Molecular Weight | 364.98 g/mol |
| LogP | 2.00628 |
| Topological Polar Surface Area | 95.98 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 364.98337 |
| Heavy Atoms | 21 |
| Complexity | 649.1781 |
Chemical Identifiers
| CAS Number | 197570-01-7 |
|---|---|
| SMILES | C1C(C(=C(NC1=O)SCC(=O)N)C#N)C2=CC=C(C=C2)Br |
Product Overview
BAS 01235545 (CAS 197570-01-7), with molecular formula C14H12BrN3O2S and molecular weight 364.98 g/mol. IUPAC: 2-[[4-(4-bromophenyl)-5-cyano-2-oxo-3,4-dihydro-1H-pyridin-6-yl]sulfanyl]acetamide.
Chemical Property Profile of BAS 01235545
Property Insights of BAS 01235545
The XLogP value of 2.00628 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 01235545. The TPSA of 95.98 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 01235545. Following Lipinski's Rule of Five, BAS 01235545 has 2 hydrogen bond donor(s) and 4 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 01235545?
The CAS number of BAS 01235545 is 197570-01-7.
What is the molecular formula of BAS 01235545?
The molecular formula of BAS 01235545 is C14H12BrN3O2S.
What is the molecular weight of BAS 01235545?
The molecular weight of BAS 01235545 is 364.98 g/mol.
Where can I buy BAS 01235545?
You can request a quote for BAS 01235545 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 01235545?
Yes, KEHONG BIO provides custom synthesis services for BAS 01235545 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.