BAS 05102237
TL;DR: BAS 05102237 (CAS 579449-22-2) is a chemical compound with molecular formula C22H19N3O2S and molecular weight 389.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(6-methyl-2-oxo-1H-quinolin-3-yl)methyl]-N-(pyridin-3-ylmethyl)thiophene-2-carboxamide
Also Known As: BAS 05102237, AT-057/43245885, N-[(6-methyl-2-oxo-1H-quinolin-3-yl)methyl]-N-(pyridin-3-ylmethyl)thiophene-2-carboxamide, N-[(6-methyl-2-oxo-1,2-dihydroquinolin-3-yl)methyl]-N-(pyridin-3-ylmethyl)thiophene-2-carboxamide, N-((2-hydroxy-6-methylquinolin-3-yl)methyl)-N-(pyridin-3-ylmethyl)thiophene-2-carboxamide
| Molecular Formula | C22H19N3O2S |
|---|---|
| Molecular Weight | 389.12 g/mol |
| LogP | 4.13562 |
| Topological Polar Surface Area | 66.06 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 389.1198 |
| Heavy Atoms | 28 |
| Complexity | 1167.5939 |
Chemical Identifiers
| CAS Number | 579449-22-2 |
|---|---|
| SMILES | CC1=CC2=C(C=C1)NC(=O)C(=C2)CN(CC3=CN=CC=C3)C(=O)C4=CC=CS4 |
Product Overview
BAS 05102237 (CAS 579449-22-2), with molecular formula C22H19N3O2S and molecular weight 389.12 g/mol. IUPAC: N-[(6-methyl-2-oxo-1H-quinolin-3-yl)methyl]-N-(pyridin-3-ylmethyl)thiophene-2-carboxamide.
Chemical Property Profile of BAS 05102237
Property Insights of BAS 05102237
The XLogP value of 4.13562 indicates that BAS 05102237 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 66.06 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 05102237. Following Lipinski's Rule of Five, BAS 05102237 has 1 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 05102237?
The CAS number of BAS 05102237 is 579449-22-2.
What is the molecular formula of BAS 05102237?
The molecular formula of BAS 05102237 is C22H19N3O2S.
What is the molecular weight of BAS 05102237?
The molecular weight of BAS 05102237 is 389.12 g/mol.
Where can I buy BAS 05102237?
You can request a quote for BAS 05102237 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 05102237?
Yes, KEHONG BIO provides custom synthesis services for BAS 05102237 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.