BAS 06900994
TL;DR: BAS 06900994 (CAS 625369-77-9) is a chemical compound with molecular formula C22H16ClN3O4S and molecular weight 453.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-amino-6-(1,3-benzodioxol-5-yl)-N-(5-chloro-2-methoxyphenyl)thieno[2,3-b]pyridine-2-carboxamide
Also Known As: BAS 06900994, 3-amino-6-(1,3-benzodioxol-5-yl)-N-(5-chloro-2-methoxyphenyl)thieno[2,3-b]pyridine-2-carboxamide, AM-807/13615290, (6-(2H-benzo[3,4-d]1,3-dioxolen-5-yl)-3-aminothiopheno[2,3-b]pyridin-2-yl)-N-( 5-chloro-2-methoxyphenyl)carboxamide, 3-amino-6-(benzo[d][1,3]dioxol-5-yl)-N-(5-chloro-2-methoxyphenyl)thieno[2,3-b]pyridine-2-carboxamide
| Molecular Formula | C22H16ClN3O4S |
|---|---|
| Molecular Weight | 453.06 g/mol |
| LogP | 5.1885 |
| Topological Polar Surface Area | 95.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 453.055 |
| Heavy Atoms | 31 |
| Complexity | 1338.0829 |
Chemical Identifiers
| CAS Number | 625369-77-9 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)Cl)NC(=O)C2=C(C3=C(S2)N=C(C=C3)C4=CC5=C(C=C4)OCO5)N |
Product Overview
BAS 06900994 (CAS 625369-77-9), with molecular formula C22H16ClN3O4S and molecular weight 453.06 g/mol. IUPAC: 3-amino-6-(1,3-benzodioxol-5-yl)-N-(5-chloro-2-methoxyphenyl)thieno[2,3-b]pyridine-2-carboxamide.
Chemical Property Profile of BAS 06900994
Property Insights of BAS 06900994
The XLogP value of 5.1885 indicates that BAS 06900994 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 95.7 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 06900994. Following Lipinski's Rule of Five, BAS 06900994 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 06900994?
The CAS number of BAS 06900994 is 625369-77-9.
What is the molecular formula of BAS 06900994?
The molecular formula of BAS 06900994 is C22H16ClN3O4S.
What is the molecular weight of BAS 06900994?
The molecular weight of BAS 06900994 is 453.06 g/mol.
Where can I buy BAS 06900994?
You can request a quote for BAS 06900994 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 06900994?
Yes, KEHONG BIO provides custom synthesis services for BAS 06900994 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.