AE-848/41150975
TL;DR: AE-848/41150975 (CAS 496771-01-8) is a chemical compound with molecular formula C16H12ClN3O4S and molecular weight 377.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-amino-2-[(3-chloro-2-methylphenyl)carbamoyl]-6-oxo-7H-thieno[2,3-b]pyridine-5-carboxylic acid
Also Known As: AE-848/41150975, 3-amino-2-((3-chloro-2-methylphenyl)carbamoyl)-6-oxo-6,7-dihydrothieno[2,3-b]pyridine-5-carboxylic acid, 3-amino-2-[(3-chloro-2-methylanilino)carbonyl]-6-oxo-6,7-dihydrothieno[2,3-b]pyridine-5-carboxylic acid, 3-amino-2-[(3-chloro-2-methylphenyl)carbamoyl]-6-oxo-7H-thieno[2,3-b]pyridine-5-carboxylic acid
| Molecular Formula | C16H12ClN3O4S |
|---|---|
| Molecular Weight | 377.02 g/mol |
| LogP | 3.08412 |
| Topological Polar Surface Area | 125.28 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 377.0237 |
| Heavy Atoms | 25 |
| Complexity | 1086.9087 |
Chemical Identifiers
| CAS Number | 496771-01-8 |
|---|---|
| SMILES | CC1=C(C=CC=C1Cl)NC(=O)C2=C(C3=C(S2)NC(=O)C(=C3)C(=O)O)N |
Product Overview
AE-848/41150975 (CAS 496771-01-8), with molecular formula C16H12ClN3O4S and molecular weight 377.02 g/mol. IUPAC: 3-amino-2-[(3-chloro-2-methylphenyl)carbamoyl]-6-oxo-7H-thieno[2,3-b]pyridine-5-carboxylic acid.
Chemical Property Profile of AE-848/41150975
Property Insights of AE-848/41150975
The XLogP value of 3.08412 indicates that AE-848/41150975 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 125.28 Ų falls within the moderate polarity range, balancing permeability and solubility for AE-848/41150975. Following Lipinski's Rule of Five, AE-848/41150975 has 4 hydrogen bond donor(s) and 5 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 AE-848/41150975?
The CAS number of AE-848/41150975 is 496771-01-8.
What is the molecular formula of AE-848/41150975?
The molecular formula of AE-848/41150975 is C16H12ClN3O4S.
What is the molecular weight of AE-848/41150975?
The molecular weight of AE-848/41150975 is 377.02 g/mol.
Where can I buy AE-848/41150975?
You can request a quote for AE-848/41150975 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AE-848/41150975?
Yes, KEHONG BIO provides custom synthesis services for AE-848/41150975 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.