N-(1H-1,3-benzodiazol-2-yl)-2-(4-chlorophenyl)-3-methylbutanamide
TL;DR: N-(1H-1,3-benzodiazol-2-yl)-2-(4-chlorophenyl)-3-methylbutanamide (CAS 851110-98-0) is a chemical compound with molecular formula C18H18ClN3O and molecular weight 327.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(1H-benzimidazol-2-yl)-2-(4-chlorophenyl)-3-methylbutanamide
Also Known As: N-(1H-1,3-benzodiazol-2-yl)-2-(4-chlorophenyl)-3-methylbutanamide, N-(1H-benzimidazol-2-yl)-2-(4-chlorophenyl)-3-methylbutanamide, rac-N-(1H-benzo[d]imidazol-2-yl)-2-(4-chlorophenyl)-3-methylbutanamide
| Molecular Formula | C18H18ClN3O |
|---|---|
| Molecular Weight | 327.11 g/mol |
| LogP | 4.5946 |
| Topological Polar Surface Area | 57.78 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 327.11383 |
| Heavy Atoms | 23 |
| Complexity | 790.6588 |
Chemical Identifiers
| CAS Number | 851110-98-0 |
|---|---|
| SMILES | CC(C)C(C1=CC=C(C=C1)Cl)C(=O)NC2=NC3=CC=CC=C3N2 |
Product Overview
N-(1H-1,3-benzodiazol-2-yl)-2-(4-chlorophenyl)-3-methylbutanamide (CAS 851110-98-0), with molecular formula C18H18ClN3O and molecular weight 327.11 g/mol. IUPAC: N-(1H-benzimidazol-2-yl)-2-(4-chlorophenyl)-3-methylbutanamide.
Chemical Property Profile of N-(1H-1,3-benzodiazol-2-yl)-2-(4-chlorophenyl)-3-methylbutanamide
Property Insights of N-(1H-1,3-benzodiazol-2-yl)-2-(4-chlorophenyl)-3-methylbutanamide
The XLogP value of 4.5946 indicates that N-(1H-1,3-benzodiazol-2-yl)-2-(4-chlorophenyl)-3-methylbutanamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 57.78 Ų, N-(1H-1,3-benzodiazol-2-yl)-2-(4-chlorophenyl)-3-methylbutanamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(1H-1,3-benzodiazol-2-yl)-2-(4-chlorophenyl)-3-methylbutanamide has 2 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 N-(1H-1,3-benzodiazol-2-yl)-2-(4-chlorophenyl)-3-methylbutanamide?
The CAS number of N-(1H-1,3-benzodiazol-2-yl)-2-(4-chlorophenyl)-3-methylbutanamide is 851110-98-0.
What is the molecular formula of N-(1H-1,3-benzodiazol-2-yl)-2-(4-chlorophenyl)-3-methylbutanamide?
The molecular formula of N-(1H-1,3-benzodiazol-2-yl)-2-(4-chlorophenyl)-3-methylbutanamide is C18H18ClN3O.
What is the molecular weight of N-(1H-1,3-benzodiazol-2-yl)-2-(4-chlorophenyl)-3-methylbutanamide?
The molecular weight of N-(1H-1,3-benzodiazol-2-yl)-2-(4-chlorophenyl)-3-methylbutanamide is 327.11 g/mol.
Where can I buy N-(1H-1,3-benzodiazol-2-yl)-2-(4-chlorophenyl)-3-methylbutanamide?
You can request a quote for N-(1H-1,3-benzodiazol-2-yl)-2-(4-chlorophenyl)-3-methylbutanamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(1H-1,3-benzodiazol-2-yl)-2-(4-chlorophenyl)-3-methylbutanamide?
Yes, KEHONG BIO provides custom synthesis services for N-(1H-1,3-benzodiazol-2-yl)-2-(4-chlorophenyl)-3-methylbutanamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.