N-(3-chloro-4-methylphenyl)-3-(1,2,4-triazol-1-yl)adamantane-1-carboxamide
TL;DR: N-(3-chloro-4-methylphenyl)-3-(1,2,4-triazol-1-yl)adamantane-1-carboxamide (CAS 514818-19-0) is a chemical compound with molecular formula C20H23ClN4O and molecular weight 370.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(3-chloro-4-methylphenyl)-3-(1,2,4-triazol-1-yl)adamantane-1-carboxamide
Also Known As: N-(3-chloro-4-methylphenyl)-3-(1,2,4-triazol-1-yl)adamantane-1-carboxamide, N-(3-chloro-4-methylphenyl)-3-(1H-1,2,4-triazol-1-yl)adamantane-1-carboxamide, N-(3-chloro-4-methylphenyl)-3-(1H-1,2,4-triazol-1-yl)tricyclo[3.3.1.1~3,7~]decane-1-carboxamide
| Molecular Formula | C20H23ClN4O |
|---|---|
| Molecular Weight | 370.16 g/mol |
| LogP | 4.17412 |
| Topological Polar Surface Area | 59.81 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 370.15604 |
| Heavy Atoms | 26 |
| Complexity | 848.70105 |
Chemical Identifiers
| CAS Number | 514818-19-0 |
|---|---|
| SMILES | CC1=C(C=C(C=C1)NC(=O)C23CC4CC(C2)CC(C4)(C3)N5C=NC=N5)Cl |
Product Overview
N-(3-chloro-4-methylphenyl)-3-(1,2,4-triazol-1-yl)adamantane-1-carboxamide (CAS 514818-19-0), with molecular formula C20H23ClN4O and molecular weight 370.16 g/mol. IUPAC: N-(3-chloro-4-methylphenyl)-3-(1,2,4-triazol-1-yl)adamantane-1-carboxamide.
Chemical Property Profile of N-(3-chloro-4-methylphenyl)-3-(1,2,4-triazol-1-yl)adamantane-1-carboxamide
Property Insights of N-(3-chloro-4-methylphenyl)-3-(1,2,4-triazol-1-yl)adamantane-1-carboxamide
The XLogP value of 4.17412 indicates that N-(3-chloro-4-methylphenyl)-3-(1,2,4-triazol-1-yl)adamantane-1-carboxamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 59.81 Ų, N-(3-chloro-4-methylphenyl)-3-(1,2,4-triazol-1-yl)adamantane-1-carboxamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(3-chloro-4-methylphenyl)-3-(1,2,4-triazol-1-yl)adamantane-1-carboxamide 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-(3-chloro-4-methylphenyl)-3-(1,2,4-triazol-1-yl)adamantane-1-carboxamide?
The CAS number of N-(3-chloro-4-methylphenyl)-3-(1,2,4-triazol-1-yl)adamantane-1-carboxamide is 514818-19-0.
What is the molecular formula of N-(3-chloro-4-methylphenyl)-3-(1,2,4-triazol-1-yl)adamantane-1-carboxamide?
The molecular formula of N-(3-chloro-4-methylphenyl)-3-(1,2,4-triazol-1-yl)adamantane-1-carboxamide is C20H23ClN4O.
What is the molecular weight of N-(3-chloro-4-methylphenyl)-3-(1,2,4-triazol-1-yl)adamantane-1-carboxamide?
The molecular weight of N-(3-chloro-4-methylphenyl)-3-(1,2,4-triazol-1-yl)adamantane-1-carboxamide is 370.16 g/mol.
Where can I buy N-(3-chloro-4-methylphenyl)-3-(1,2,4-triazol-1-yl)adamantane-1-carboxamide?
You can request a quote for N-(3-chloro-4-methylphenyl)-3-(1,2,4-triazol-1-yl)adamantane-1-carboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(3-chloro-4-methylphenyl)-3-(1,2,4-triazol-1-yl)adamantane-1-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for N-(3-chloro-4-methylphenyl)-3-(1,2,4-triazol-1-yl)adamantane-1-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.