N-(1H-benzimidazol-2-ylmethyl)-1-(2-methoxyphenyl)methanamine
TL;DR: N-(1H-benzimidazol-2-ylmethyl)-1-(2-methoxyphenyl)methanamine (CAS 176648-48-9) is a chemical compound with molecular formula C16H17N3O and molecular weight 267.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(1H-benzimidazol-2-ylmethyl)-1-(2-methoxyphenyl)methanamine
Also Known As: NCI60_028937, N-(1H-benzimidazol-2-ylmethyl)-1-(2-methoxyphenyl)methanamine, N-[(2-Methoxyphenyl)methyl]-1H-benzimidazole-2-methanamine, 1-(1H-Benzimidazol-2-yl)-N-[(2-methoxyphenyl)methyl]methanamine, N-(1H-Benzimidazol-2-ylmethyl)(2-methoxyphenyl)methanamine hydrochloride
| Molecular Formula | C16H17N3O |
|---|---|
| Molecular Weight | 267.14 g/mol |
| LogP | 2.4 |
| Topological Polar Surface Area | 49.9 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 267.13718 |
| Heavy Atoms | 20 |
| Complexity | 299.0 |
Chemical Identifiers
| CAS Number | 176648-48-9 |
|---|---|
| SMILES | COC1=CC=CC=C1CNCC2=NC3=CC=CC=C3N2 |
| InChIKey | PKYQXJSCPUVPKI-UHFFFAOYSA-N |
Product Overview
N-(1H-benzimidazol-2-ylmethyl)-1-(2-methoxyphenyl)methanamine (CAS 176648-48-9), with molecular formula C16H17N3O and molecular weight 267.14 g/mol. IUPAC: N-(1H-benzimidazol-2-ylmethyl)-1-(2-methoxyphenyl)methanamine.
Chemical Property Profile of N-(1H-benzimidazol-2-ylmethyl)-1-(2-methoxyphenyl)methanamine
Property Insights of N-(1H-benzimidazol-2-ylmethyl)-1-(2-methoxyphenyl)methanamine
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(1H-benzimidazol-2-ylmethyl)-1-(2-methoxyphenyl)methanamine. With a topological polar surface area (TPSA) of 49.9 Ų, N-(1H-benzimidazol-2-ylmethyl)-1-(2-methoxyphenyl)methanamine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(1H-benzimidazol-2-ylmethyl)-1-(2-methoxyphenyl)methanamine has 2 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-(1H-benzimidazol-2-ylmethyl)-1-(2-methoxyphenyl)methanamine?
The CAS number of N-(1H-benzimidazol-2-ylmethyl)-1-(2-methoxyphenyl)methanamine is 176648-48-9.
What is the molecular formula of N-(1H-benzimidazol-2-ylmethyl)-1-(2-methoxyphenyl)methanamine?
The molecular formula of N-(1H-benzimidazol-2-ylmethyl)-1-(2-methoxyphenyl)methanamine is C16H17N3O.
What is the molecular weight of N-(1H-benzimidazol-2-ylmethyl)-1-(2-methoxyphenyl)methanamine?
The molecular weight of N-(1H-benzimidazol-2-ylmethyl)-1-(2-methoxyphenyl)methanamine is 267.14 g/mol.
Where can I buy N-(1H-benzimidazol-2-ylmethyl)-1-(2-methoxyphenyl)methanamine?
You can request a quote for N-(1H-benzimidazol-2-ylmethyl)-1-(2-methoxyphenyl)methanamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(1H-benzimidazol-2-ylmethyl)-1-(2-methoxyphenyl)methanamine?
Yes, KEHONG BIO provides custom synthesis services for N-(1H-benzimidazol-2-ylmethyl)-1-(2-methoxyphenyl)methanamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.