BAS 03318001
TL;DR: BAS 03318001 (CAS 335207-13-1) is a chemical compound with molecular formula C22H14ClN3O2S and molecular weight 419.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-chloro-N-[2-methyl-3-([1,3]oxazolo[4,5-b]pyridin-2-yl)phenyl]-1-benzothiophene-2-carboxamide
Also Known As: BAS 03318001, AB00105095-01, AP-970/14929032, 3-chloro-N-[2-methyl-3-([1,3]oxazolo[4,5-b]pyridin-2-yl)phenyl]-1-benzothiophene-2-carboxamide, (3-chlorobenzo[b]thiophen-2-yl)-N-(2-methyl-3-(1,3-oxazolo[4,5-b]pyridin-2-yl) phenyl)carboxamide
| Molecular Formula | C22H14ClN3O2S |
|---|---|
| Molecular Weight | 419.05 g/mol |
| LogP | 6.31862 |
| Topological Polar Surface Area | 68.02 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 419.04953 |
| Heavy Atoms | 29 |
| Complexity | 1356.6344 |
Chemical Identifiers
| CAS Number | 335207-13-1 |
|---|---|
| SMILES | CC1=C(C=CC=C1NC(=O)C2=C(C3=CC=CC=C3S2)Cl)C4=NC5=C(O4)C=CC=N5 |
Product Overview
BAS 03318001 (CAS 335207-13-1), with molecular formula C22H14ClN3O2S and molecular weight 419.05 g/mol. IUPAC: 3-chloro-N-[2-methyl-3-([1,3]oxazolo[4,5-b]pyridin-2-yl)phenyl]-1-benzothiophene-2-carboxamide.
Chemical Property Profile of BAS 03318001
Property Insights of BAS 03318001
The XLogP value of 6.31862 indicates that BAS 03318001 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 68.02 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 03318001. Following Lipinski's Rule of Five, BAS 03318001 has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of BAS 03318001?
The CAS number of BAS 03318001 is 335207-13-1.
What is the molecular formula of BAS 03318001?
The molecular formula of BAS 03318001 is C22H14ClN3O2S.
What is the molecular weight of BAS 03318001?
The molecular weight of BAS 03318001 is 419.05 g/mol.
Where can I buy BAS 03318001?
You can request a quote for BAS 03318001 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 03318001?
Yes, KEHONG BIO provides custom synthesis services for BAS 03318001 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.