Nicopyron
TL;DR: Nicopyron (CAS 95873-63-5) is a chemical compound with molecular formula C19H20ClN5O3 and molecular weight 401.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[2-[(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)amino]-2-oxoethyl]pyridine-3-carboxamide;hydrochloride
Also Known As: Nicopyron, nifenazone, Nicotinamide, N-((antipyrinylcarbamoyl)methyl)-, hydrochloride, 4-(N-Nicotinoylaminoacetylamino)-1-phenyl-2,3-dimethyl-pyrazolon-(5) hydrochlorid [German], N-(2-((2,3-Dihydro-1,5-dimethyl-3-oxo-2-phenyl-1H-pyrazol-4-yl)amino)-2-oxoethyl)nicotinamide monohydrochloride
| Molecular Formula | C19H20ClN5O3 |
|---|---|
| Molecular Weight | 401.13 g/mol |
| LogP | 1.66972 |
| Topological Polar Surface Area | 94.6 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 401.12546 |
| Heavy Atoms | 28 |
| Complexity | 627.0 |
Chemical Identifiers
| CAS Number | 95873-63-5 |
|---|---|
| SMILES | CC1=C(C(=O)N(N1C)C2=CC=CC=C2)NC(=O)CNC(=O)C3=CN=CC=C3.Cl |
| InChIKey | KUACECLRQMFTQS-UHFFFAOYSA-N |
Product Overview
Nicopyron (CAS 95873-63-5), with molecular formula C19H20ClN5O3 and molecular weight 401.13 g/mol. IUPAC: N-[2-[(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)amino]-2-oxoethyl]pyridine-3-carboxamide;hydrochloride.
Chemical Property Profile of Nicopyron
Property Insights of Nicopyron
The XLogP value of 1.66972 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Nicopyron. The TPSA of 94.6 Ų falls within the moderate polarity range, balancing permeability and solubility for Nicopyron. Following Lipinski's Rule of Five, Nicopyron has 3 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 Nicopyron?
The CAS number of Nicopyron is 95873-63-5.
What is the molecular formula of Nicopyron?
The molecular formula of Nicopyron is C19H20ClN5O3.
What is the molecular weight of Nicopyron?
The molecular weight of Nicopyron is 401.13 g/mol.
Where can I buy Nicopyron?
You can request a quote for Nicopyron directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Nicopyron?
Yes, KEHONG BIO provides custom synthesis services for Nicopyron and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.