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N-[(1H-1,3-benzodiazol-2-yl)methyl]benzamide
TL;DR: N-[(1H-1,3-benzodiazol-2-yl)methyl]benzamide (CAS 5805-60-7) is a chemical compound with molecular formula C15H13N3O and molecular weight 251.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(1H-benzimidazol-2-ylmethyl)benzamide
Also Known As: N-(1H-Benzoimidazol-2-ylmethyl)-benzamide, N- -BENZAMIDE, N-(1H-benzimidazol-2-ylmethyl)benzamide, CBKinase1_000151, CBKinase1_012551
| Molecular Formula | C15H13N3O |
|---|---|
| Molecular Weight | 251.11 g/mol |
| LogP | 2.3 |
| Topological Polar Surface Area | 57.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 251.10587 |
| Heavy Atoms | 19 |
| Complexity | 315.0 |
Chemical Identifiers
| CAS Number | 5805-60-7 |
|---|---|
| SMILES | C1=CC=C(C=C1)C(=O)NCC2=NC3=CC=CC=C3N2 |
| InChIKey | DLPWNQUPBLICPH-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
N-[(1H-1,3-benzodiazol-2-yl)methyl]benzamide (CAS 5805-60-7), with molecular formula C15H13N3O and molecular weight 251.11 g/mol. IUPAC: N-(1H-benzimidazol-2-ylmethyl)benzamide.
Chemical Property Profile of N-[(1H-1,3-benzodiazol-2-yl)methyl]benzamide
Property Insights of N-[(1H-1,3-benzodiazol-2-yl)methyl]benzamide
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-[(1H-1,3-benzodiazol-2-yl)methyl]benzamide. With a topological polar surface area (TPSA) of 57.8 Ų, N-[(1H-1,3-benzodiazol-2-yl)methyl]benzamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-[(1H-1,3-benzodiazol-2-yl)methyl]benzamide 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)methyl]benzamide?
The CAS number of N-[(1H-1,3-benzodiazol-2-yl)methyl]benzamide is 5805-60-7.
What is the molecular formula of N-[(1H-1,3-benzodiazol-2-yl)methyl]benzamide?
The molecular formula of N-[(1H-1,3-benzodiazol-2-yl)methyl]benzamide is C15H13N3O.
What is the molecular weight of N-[(1H-1,3-benzodiazol-2-yl)methyl]benzamide?
The molecular weight of N-[(1H-1,3-benzodiazol-2-yl)methyl]benzamide is 251.11 g/mol.
Where can I buy N-[(1H-1,3-benzodiazol-2-yl)methyl]benzamide?
You can request a quote for N-[(1H-1,3-benzodiazol-2-yl)methyl]benzamide 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)methyl]benzamide?
Yes, KEHONG BIO provides custom synthesis services for N-[(1H-1,3-benzodiazol-2-yl)methyl]benzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.