N-苄基-5-氯吡嗪-2-甲酰胺
TL;DR: N-苄基-5-氯吡嗪-2-甲酰胺 (CAS 958799-53-6) is a chemical compound with molecular formula C12H10ClN3O and molecular weight 247.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-苄基-5-氯吡嗪-2-甲酰胺
N-benzyl-5-chloropyrazine-2-carboxamide
Also Known As: N-benzyl-5-chloropyrazine-2-carboxamide, N-benzyl-5-chloro-pyrazine-2-carboxamide, 5-Chloro-pyrazine-2-carboxylic acid benzylamide
| Molecular Formula | C12H10ClN3O |
|---|---|
| Molecular Weight | 247.05 g/mol |
| LogP | 1.8 |
| Topological Polar Surface Area | 54.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 247.05124 |
| Heavy Atoms | 17 |
| Complexity | 256.0 |
Chemical Identifiers
| CAS Number | 958799-53-6 |
|---|---|
| SMILES | C1=CC=C(C=C1)CNC(=O)C2=CN=C(C=N2)Cl |
| InChIKey | ACZUOVLQJHTYDK-UHFFFAOYSA-N |
Product Overview
N-苄基-5-氯吡嗪-2-甲酰胺 (CAS 958799-53-6), with molecular formula C12H10ClN3O and molecular weight 247.05 g/mol. IUPAC: N-benzyl-5-chloropyrazine-2-carboxamide.
Chemical Property Profile of N-苄基-5-氯吡嗪-2-甲酰胺
Property Insights of N-苄基-5-氯吡嗪-2-甲酰胺
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-苄基-5-氯吡嗪-2-甲酰胺. With a topological polar surface area (TPSA) of 54.9 Ų, N-苄基-5-氯吡嗪-2-甲酰胺 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-苄基-5-氯吡嗪-2-甲酰胺 has 1 hydrogen bond donor(s) and 3 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 N-苄基-5-氯吡嗪-2-甲酰胺?
The CAS number of N-苄基-5-氯吡嗪-2-甲酰胺 is 958799-53-6.
What is the molecular formula of N-苄基-5-氯吡嗪-2-甲酰胺?
The molecular formula of N-苄基-5-氯吡嗪-2-甲酰胺 is C12H10ClN3O.
What is the molecular weight of N-苄基-5-氯吡嗪-2-甲酰胺?
The molecular weight of N-苄基-5-氯吡嗪-2-甲酰胺 is 247.05 g/mol.
Where can I buy N-苄基-5-氯吡嗪-2-甲酰胺?
You can request a quote for N-苄基-5-氯吡嗪-2-甲酰胺 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-苄基-5-氯吡嗪-2-甲酰胺?
Yes, KEHONG BIO provides custom synthesis services for N-苄基-5-氯吡嗪-2-甲酰胺 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.