BAS 01280028
TL;DR: BAS 01280028 (CAS 332176-02-0) is a chemical compound with molecular formula C26H21N3OS and molecular weight 423.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(3-cyano-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-phenylquinoline-4-carboxamide
Also Known As: BAS 01280028, N-(3-cyano-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-phenylquinoline-4-carboxamide, F0375-0345, N-(3-cyano-6-methyl-4,5,6,7-tetrahydrobenzo[b]thiophen-2-yl)-2-phenylquinoline-4-carboxamide, N-(3-cyano-6-methyl-1-thia-4,5,6,7-tetrahydro-2-indenyl)-2-phenyl-4-quinolinecarboxamide
| Molecular Formula | C26H21N3OS |
|---|---|
| Molecular Weight | 423.14 g/mol |
| LogP | 6.21208 |
| Topological Polar Surface Area | 65.78 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 423.14053 |
| Heavy Atoms | 31 |
| Complexity | 1334.2736 |
Chemical Identifiers
| CAS Number | 332176-02-0 |
|---|---|
| SMILES | CC1CCC2=C(C1)SC(=C2C#N)NC(=O)C3=CC(=NC4=CC=CC=C43)C5=CC=CC=C5 |
Product Overview
BAS 01280028 (CAS 332176-02-0), with molecular formula C26H21N3OS and molecular weight 423.14 g/mol. IUPAC: N-(3-cyano-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-phenylquinoline-4-carboxamide.
Chemical Property Profile of BAS 01280028
Property Insights of BAS 01280028
The XLogP value of 6.21208 indicates that BAS 01280028 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 65.78 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 01280028. Following Lipinski's Rule of Five, BAS 01280028 has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of BAS 01280028?
The CAS number of BAS 01280028 is 332176-02-0.
What is the molecular formula of BAS 01280028?
The molecular formula of BAS 01280028 is C26H21N3OS.
What is the molecular weight of BAS 01280028?
The molecular weight of BAS 01280028 is 423.14 g/mol.
Where can I buy BAS 01280028?
You can request a quote for BAS 01280028 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 01280028?
Yes, KEHONG BIO provides custom synthesis services for BAS 01280028 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.