![3-[(3,4-Dichloroanilino)carbonyl]-2-pyrazinecarboxylic acid structure](/static/products/3127/312751-33-0.webp)
3-[(3,4-Dichloroanilino)carbonyl]-2-pyrazinecarboxylic acid
TL;DR: 3-[(3,4-Dichloroanilino)carbonyl]-2-pyrazinecarboxylic acid (CAS 312751-33-0) is a chemical compound with molecular formula C12H7Cl2N3O3 and molecular weight 310.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[(3,4-dichlorophenyl)carbamoyl]pyrazine-2-carboxylic acid
Also Known As: EC-000.1257, 3-[(3,4-dichloroanilino)carbonyl]-2-pyrazinecarboxylic acid, 3-((3,4-dichlorophenyl)carbamoyl)pyrazine-2-carboxylic acid, 3-[(3,4-dichlorophenyl)carbamoyl]pyrazine-2-carboxylic acid, 3-[N-(3,4-dichlorophenyl)carbamoyl]pyrazine-2-carboxylic acid
| Molecular Formula | C12H7Cl2N3O3 |
|---|---|
| Molecular Weight | 310.99 g/mol |
| LogP | 2.1 |
| Topological Polar Surface Area | 92.2 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 310.98645 |
| Heavy Atoms | 20 |
| Complexity | 383.0 |
Chemical Identifiers
| CAS Number | 312751-33-0 |
|---|---|
| SMILES | C1=CC(=C(C=C1NC(=O)C2=NC=CN=C2C(=O)O)Cl)Cl |
| InChIKey | NZGAAYIBGMFDHO-UHFFFAOYSA-N |
Product Overview
3-[(3,4-Dichloroanilino)carbonyl]-2-pyrazinecarboxylic acid (CAS 312751-33-0), with molecular formula C12H7Cl2N3O3 and molecular weight 310.99 g/mol. IUPAC: 3-[(3,4-dichlorophenyl)carbamoyl]pyrazine-2-carboxylic acid.
Chemical Property Profile of 3-[(3,4-Dichloroanilino)carbonyl]-2-pyrazinecarboxylic acid
Property Insights of 3-[(3,4-Dichloroanilino)carbonyl]-2-pyrazinecarboxylic acid
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-[(3,4-Dichloroanilino)carbonyl]-2-pyrazinecarboxylic acid. The TPSA of 92.2 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-[(3,4-Dichloroanilino)carbonyl]-2-pyrazinecarboxylic acid. Following Lipinski's Rule of Five, 3-[(3,4-Dichloroanilino)carbonyl]-2-pyrazinecarboxylic acid has 2 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 3-[(3,4-Dichloroanilino)carbonyl]-2-pyrazinecarboxylic acid?
The CAS number of 3-[(3,4-Dichloroanilino)carbonyl]-2-pyrazinecarboxylic acid is 312751-33-0.
What is the molecular formula of 3-[(3,4-Dichloroanilino)carbonyl]-2-pyrazinecarboxylic acid?
The molecular formula of 3-[(3,4-Dichloroanilino)carbonyl]-2-pyrazinecarboxylic acid is C12H7Cl2N3O3.
What is the molecular weight of 3-[(3,4-Dichloroanilino)carbonyl]-2-pyrazinecarboxylic acid?
The molecular weight of 3-[(3,4-Dichloroanilino)carbonyl]-2-pyrazinecarboxylic acid is 310.99 g/mol.
Where can I buy 3-[(3,4-Dichloroanilino)carbonyl]-2-pyrazinecarboxylic acid?
You can request a quote for 3-[(3,4-Dichloroanilino)carbonyl]-2-pyrazinecarboxylic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-[(3,4-Dichloroanilino)carbonyl]-2-pyrazinecarboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for 3-[(3,4-Dichloroanilino)carbonyl]-2-pyrazinecarboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.