BAS 00867689
TL;DR: BAS 00867689 (CAS 332053-72-2) is a chemical compound with molecular formula C27H20N4O4S and molecular weight 496.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-amino-4-(4-methoxyphenyl)-N-(2-nitrophenyl)-6-phenylthieno[2,3-b]pyridine-2-carboxamide
Also Known As: BAS 00867689, 3-amino-4-(4-methoxyphenyl)-N-(2-nitrophenyl)-6-phenylthieno[2,3-b]pyridine-2-carboxamide, 3-amino-N-{2-nitrophenyl}-4-(4-methoxyphenyl)-6-phenylthieno[2,3-b]pyridine-2-carboxamide, 3-Amino-4-(4-methoxy-phenyl)-6-phenyl-thieno[2,3-b]pyridine-2-carboxylic acid (2-nitro-phenyl)-amide
| Molecular Formula | C27H20N4O4S |
|---|---|
| Molecular Weight | 496.12 g/mol |
| LogP | 6.3816 |
| Topological Polar Surface Area | 120.38 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 496.1205 |
| Heavy Atoms | 36 |
| Complexity | 1598.2434 |
Chemical Identifiers
| CAS Number | 332053-72-2 |
|---|---|
| SMILES | COC1=CC=C(C=C1)C2=CC(=NC3=C2C(=C(S3)C(=O)NC4=CC=CC=C4[N+](=O)[O-])N)C5=CC=CC=C5 |
Product Overview
BAS 00867689 (CAS 332053-72-2), with molecular formula C27H20N4O4S and molecular weight 496.12 g/mol. IUPAC: 3-amino-4-(4-methoxyphenyl)-N-(2-nitrophenyl)-6-phenylthieno[2,3-b]pyridine-2-carboxamide.
Chemical Property Profile of BAS 00867689
Property Insights of BAS 00867689
The XLogP value of 6.3816 indicates that BAS 00867689 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 120.38 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 00867689. Following Lipinski's Rule of Five, BAS 00867689 has 2 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of BAS 00867689?
The CAS number of BAS 00867689 is 332053-72-2.
What is the molecular formula of BAS 00867689?
The molecular formula of BAS 00867689 is C27H20N4O4S.
What is the molecular weight of BAS 00867689?
The molecular weight of BAS 00867689 is 496.12 g/mol.
Where can I buy BAS 00867689?
You can request a quote for BAS 00867689 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00867689?
Yes, KEHONG BIO provides custom synthesis services for BAS 00867689 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.