3-Pyridinecarboxamide, N-(chloromethyl)-
TL;DR: 3-Pyridinecarboxamide, N-(chloromethyl)- (CAS 55830-23-4) is a chemical compound with molecular formula C7H7ClN2O and molecular weight 170.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(chloromethyl)pyridine-3-carboxamide
Also Known As: 3-Pyridinecarboxamide, N-(chloromethyl)-, N-(Chloromethyl)-3-pyridinecarboxamide, N-(chloromethyl)pyridine-3-carboxamide
| Molecular Formula | C7H7ClN2O |
|---|---|
| Molecular Weight | 170.02 g/mol |
| LogP | 0.6 |
| Topological Polar Surface Area | 42.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 170.02469 |
| Heavy Atoms | 11 |
| Complexity | 140.0 |
Chemical Identifiers
| CAS Number | 55830-23-4 |
|---|---|
| SMILES | C1=CC(=CN=C1)C(=O)NCCl |
| InChIKey | KWQVQBSZPFRKIR-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-Pyridinecarboxamide, N-(chloromethyl)- (CAS 55830-23-4), with molecular formula C7H7ClN2O and molecular weight 170.02 g/mol. IUPAC: N-(chloromethyl)pyridine-3-carboxamide.
Chemical Property Profile of 3-Pyridinecarboxamide, N-(chloromethyl)-
Property Insights of 3-Pyridinecarboxamide, N-(chloromethyl)-
The XLogP value of 0.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Pyridinecarboxamide, N-(chloromethyl)-. With a topological polar surface area (TPSA) of 42.0 Ų, 3-Pyridinecarboxamide, N-(chloromethyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Pyridinecarboxamide, N-(chloromethyl)- has 1 hydrogen bond donor(s) and 2 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-Pyridinecarboxamide, N-(chloromethyl)-?
The CAS number of 3-Pyridinecarboxamide, N-(chloromethyl)- is 55830-23-4.
What is the molecular formula of 3-Pyridinecarboxamide, N-(chloromethyl)-?
The molecular formula of 3-Pyridinecarboxamide, N-(chloromethyl)- is C7H7ClN2O.
What is the molecular weight of 3-Pyridinecarboxamide, N-(chloromethyl)-?
The molecular weight of 3-Pyridinecarboxamide, N-(chloromethyl)- is 170.02 g/mol.
Where can I buy 3-Pyridinecarboxamide, N-(chloromethyl)-?
You can request a quote for 3-Pyridinecarboxamide, N-(chloromethyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Pyridinecarboxamide, N-(chloromethyl)-?
Yes, KEHONG BIO provides custom synthesis services for 3-Pyridinecarboxamide, N-(chloromethyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.