BAS 12534386
TL;DR: BAS 12534386 (CAS 876667-72-0) is a chemical compound with molecular formula C15H15ClN2O4 and molecular weight 322.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 4-[(3-chlorophenyl)carbamoyl]-6-methyl-2-oxo-3,4-dihydro-1H-pyridine-5-carboxylate
Also Known As: BAS 12534386, A4014/0171185, methyl 4-[(3-chlorophenyl)carbamoyl]-6-hydroxy-2-methyl-4,5-dihydropyridine-3-carboxylate, methyl 4-[(3-chlorophenyl)carbamoyl]-2-methyl-6-oxo-1,4,5,6-tetrahydropyridine-3-carboxylate, methyl 4-[(3-chlorophenyl)carbamoyl]-6-methyl-2-oxo-3,4-dihydro-1H-pyridine-5-carboxylate
| Molecular Formula | C15H15ClN2O4 |
|---|---|
| Molecular Weight | 322.07 g/mol |
| LogP | 1.8616 |
| Topological Polar Surface Area | 84.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 322.07202 |
| Heavy Atoms | 22 |
| Complexity | 669.2612 |
Chemical Identifiers
| CAS Number | 876667-72-0 |
|---|---|
| SMILES | CC1=C(C(CC(=O)N1)C(=O)NC2=CC(=CC=C2)Cl)C(=O)OC |
Product Overview
BAS 12534386 (CAS 876667-72-0), with molecular formula C15H15ClN2O4 and molecular weight 322.07 g/mol. IUPAC: methyl 4-[(3-chlorophenyl)carbamoyl]-6-methyl-2-oxo-3,4-dihydro-1H-pyridine-5-carboxylate.
Chemical Property Profile of BAS 12534386
Property Insights of BAS 12534386
The XLogP value of 1.8616 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 12534386. The TPSA of 84.5 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 12534386. Following Lipinski's Rule of Five, BAS 12534386 has 2 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 12534386?
The CAS number of BAS 12534386 is 876667-72-0.
What is the molecular formula of BAS 12534386?
The molecular formula of BAS 12534386 is C15H15ClN2O4.
What is the molecular weight of BAS 12534386?
The molecular weight of BAS 12534386 is 322.07 g/mol.
Where can I buy BAS 12534386?
You can request a quote for BAS 12534386 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 12534386?
Yes, KEHONG BIO provides custom synthesis services for BAS 12534386 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.