![N-[(2-chlorophenyl)methyl]-3-(1,2,4-triazol-1-yl)adamantane-1-carboxamide structure](/static/products/4449/444936-79-2.webp)
N-[(2-chlorophenyl)methyl]-3-(1,2,4-triazol-1-yl)adamantane-1-carboxamide
TL;DR: N-[(2-chlorophenyl)methyl]-3-(1,2,4-triazol-1-yl)adamantane-1-carboxamide (CAS 444936-79-2) 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-[(2-chlorophenyl)methyl]-3-(1,2,4-triazol-1-yl)adamantane-1-carboxamide
Also Known As: N-[(2-chlorophenyl)methyl]-3-(1,2,4-triazol-1-yl)adamantane-1-carboxamide, N-(2-chlorobenzyl)-3-(1H-1,2,4-triazol-1-yl)-1-adamantanecarboxamide, N-(2-chlorobenzyl)-3-(1H-1,2,4-triazol-1-yl)tricyclo[3.3.1.1~3,7~]decane-1-carboxamide, N~1~-(2-CHLOROBENZYL)-3-(1H-1,2,4-TRIAZOL-1-YL)-1-ADAMANTANECARBOXAMIDE
| Molecular Formula | C20H23ClN4O |
|---|---|
| Molecular Weight | 370.16 g/mol |
| LogP | 3.5434 |
| Topological Polar Surface Area | 59.81 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 370.15604 |
| Heavy Atoms | 26 |
| Complexity | 820.09656 |
Chemical Identifiers
| CAS Number | 444936-79-2 |
|---|---|
| SMILES | C1C2CC3(CC1CC(C2)(C3)N4C=NC=N4)C(=O)NCC5=CC=CC=C5Cl |
Product Overview
N-[(2-chlorophenyl)methyl]-3-(1,2,4-triazol-1-yl)adamantane-1-carboxamide (CAS 444936-79-2), with molecular formula C20H23ClN4O and molecular weight 370.16 g/mol. IUPAC: N-[(2-chlorophenyl)methyl]-3-(1,2,4-triazol-1-yl)adamantane-1-carboxamide.
Chemical Property Profile of N-[(2-chlorophenyl)methyl]-3-(1,2,4-triazol-1-yl)adamantane-1-carboxamide
Property Insights of N-[(2-chlorophenyl)methyl]-3-(1,2,4-triazol-1-yl)adamantane-1-carboxamide
The XLogP value of 3.5434 indicates that N-[(2-chlorophenyl)methyl]-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-[(2-chlorophenyl)methyl]-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-[(2-chlorophenyl)methyl]-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-[(2-chlorophenyl)methyl]-3-(1,2,4-triazol-1-yl)adamantane-1-carboxamide?
The CAS number of N-[(2-chlorophenyl)methyl]-3-(1,2,4-triazol-1-yl)adamantane-1-carboxamide is 444936-79-2.
What is the molecular formula of N-[(2-chlorophenyl)methyl]-3-(1,2,4-triazol-1-yl)adamantane-1-carboxamide?
The molecular formula of N-[(2-chlorophenyl)methyl]-3-(1,2,4-triazol-1-yl)adamantane-1-carboxamide is C20H23ClN4O.
What is the molecular weight of N-[(2-chlorophenyl)methyl]-3-(1,2,4-triazol-1-yl)adamantane-1-carboxamide?
The molecular weight of N-[(2-chlorophenyl)methyl]-3-(1,2,4-triazol-1-yl)adamantane-1-carboxamide is 370.16 g/mol.
Where can I buy N-[(2-chlorophenyl)methyl]-3-(1,2,4-triazol-1-yl)adamantane-1-carboxamide?
You can request a quote for N-[(2-chlorophenyl)methyl]-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-[(2-chlorophenyl)methyl]-3-(1,2,4-triazol-1-yl)adamantane-1-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for N-[(2-chlorophenyl)methyl]-3-(1,2,4-triazol-1-yl)adamantane-1-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.