Methyl-(5-methoxybenzyl-1H-benzimidazol-2-yl)carbamate
TL;DR: Methyl-(5-methoxybenzyl-1H-benzimidazol-2-yl)carbamate (CAS 149756-98-9) is a chemical compound with molecular formula C17H17N3O3 and molecular weight 311.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl N-[6-[methoxy(phenyl)methyl]-1H-benzimidazol-2-yl]carbamate
Also Known As: Umf 058, Methyl-(5-methoxybenzyl-1H-benzimidazol-2-yl)carbamate, methyl N-[6-[methoxy(phenyl)methyl]-1H-benzimidazol-2-yl]carbamate, Methyl (5-(methoxy(phenyl)methyl)-1H-benzo[d]imidazol-2-yl)carbamate, Carbamic acid, (5-(methoxyphenylmethyl)-1H-benzimidazol-2-yl)-, methyl ester
| Molecular Formula | C17H17N3O3 |
|---|---|
| Molecular Weight | 311.13 g/mol |
| LogP | 2.9 |
| Topological Polar Surface Area | 76.2 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 311.12698 |
| Heavy Atoms | 23 |
| Complexity | 401.0 |
Chemical Identifiers
| CAS Number | 149756-98-9 |
|---|---|
| SMILES | COC(C1=CC=CC=C1)C2=CC3=C(C=C2)N=C(N3)NC(=O)OC |
| InChIKey | RPVFSNFGYQGGPV-UHFFFAOYSA-N |
Product Overview
Methyl-(5-methoxybenzyl-1H-benzimidazol-2-yl)carbamate (CAS 149756-98-9), with molecular formula C17H17N3O3 and molecular weight 311.13 g/mol. IUPAC: methyl N-[6-[methoxy(phenyl)methyl]-1H-benzimidazol-2-yl]carbamate.
Chemical Property Profile of Methyl-(5-methoxybenzyl-1H-benzimidazol-2-yl)carbamate
Property Insights of Methyl-(5-methoxybenzyl-1H-benzimidazol-2-yl)carbamate
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl-(5-methoxybenzyl-1H-benzimidazol-2-yl)carbamate. The TPSA of 76.2 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl-(5-methoxybenzyl-1H-benzimidazol-2-yl)carbamate. Following Lipinski's Rule of Five, Methyl-(5-methoxybenzyl-1H-benzimidazol-2-yl)carbamate has 2 hydrogen bond donor(s) and 4 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 Methyl-(5-methoxybenzyl-1H-benzimidazol-2-yl)carbamate?
The CAS number of Methyl-(5-methoxybenzyl-1H-benzimidazol-2-yl)carbamate is 149756-98-9.
What is the molecular formula of Methyl-(5-methoxybenzyl-1H-benzimidazol-2-yl)carbamate?
The molecular formula of Methyl-(5-methoxybenzyl-1H-benzimidazol-2-yl)carbamate is C17H17N3O3.
What is the molecular weight of Methyl-(5-methoxybenzyl-1H-benzimidazol-2-yl)carbamate?
The molecular weight of Methyl-(5-methoxybenzyl-1H-benzimidazol-2-yl)carbamate is 311.13 g/mol.
Where can I buy Methyl-(5-methoxybenzyl-1H-benzimidazol-2-yl)carbamate?
You can request a quote for Methyl-(5-methoxybenzyl-1H-benzimidazol-2-yl)carbamate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl-(5-methoxybenzyl-1H-benzimidazol-2-yl)carbamate?
Yes, KEHONG BIO provides custom synthesis services for Methyl-(5-methoxybenzyl-1H-benzimidazol-2-yl)carbamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.