BAS 01251412
TL;DR: BAS 01251412 (CAS 329074-25-1) is a chemical compound with molecular formula C14H13ClN2O5 and molecular weight 324.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 4-(4-chloro-3-nitrophenyl)-6-methyl-2-oxo-3,4-dihydro-1H-pyridine-5-carboxylate
Also Known As: BAS 01251412, methyl 4-(4-chloro-3-nitrophenyl)-2-methyl-6-oxo-1,4,5,6-tetrahydropyridine-3-carboxylate, methyl 4-(4-chloro-3-nitrophenyl)-2-methyl-6-oxo-1,4,5,6-tetrahydro-3-pyridinecarboxylate, methyl 4-(4-chloro-3-nitrophenyl)-2-methyl-6-oxo-1,4,5-trihydropyridine-3-carb oxylate, methyl 4-(4-chloro-3-nitrophenyl)-2-methyl-6-oxo-4,5-dihydro-1H-pyridine-3-carboxylate
| Molecular Formula | C14H13ClN2O5 |
|---|---|
| Molecular Weight | 324.05 g/mol |
| LogP | 2.2987 |
| Topological Polar Surface Area | 98.54 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 324.0513 |
| Heavy Atoms | 22 |
| Complexity | 698.47363 |
Chemical Identifiers
| CAS Number | 329074-25-1 |
|---|---|
| SMILES | CC1=C(C(CC(=O)N1)C2=CC(=C(C=C2)Cl)[N+](=O)[O-])C(=O)OC |
Product Overview
BAS 01251412 (CAS 329074-25-1), with molecular formula C14H13ClN2O5 and molecular weight 324.05 g/mol. IUPAC: methyl 4-(4-chloro-3-nitrophenyl)-6-methyl-2-oxo-3,4-dihydro-1H-pyridine-5-carboxylate.
Chemical Property Profile of BAS 01251412
Property Insights of BAS 01251412
The XLogP value of 2.2987 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 01251412. The TPSA of 98.54 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 01251412. Following Lipinski's Rule of Five, BAS 01251412 has 1 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 BAS 01251412?
The CAS number of BAS 01251412 is 329074-25-1.
What is the molecular formula of BAS 01251412?
The molecular formula of BAS 01251412 is C14H13ClN2O5.
What is the molecular weight of BAS 01251412?
The molecular weight of BAS 01251412 is 324.05 g/mol.
Where can I buy BAS 01251412?
You can request a quote for BAS 01251412 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 01251412?
Yes, KEHONG BIO provides custom synthesis services for BAS 01251412 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.