methyl N-[5-(isopentyloxy)-1H-1,3-benzimidazol-2-yl]carbamate
TL;DR: methyl N-[5-(isopentyloxy)-1H-1,3-benzimidazol-2-yl]carbamate (CAS 352225-80-0) is a chemical compound with molecular formula C14H19N3O3 and molecular weight 277.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl N-[6-(3-methylbutoxy)-1H-benzimidazol-2-yl]carbamate
Also Known As: methyl N-[5-(isopentyloxy)-1H-1,3-benzimidazol-2-yl]carbamate, methyl N-[6-(3-methylbutoxy)-1H-benzimidazol-2-yl]carbamate, methyl N-[5-(3-methylbutoxy)-1H-1,3-benzodiazol-2-yl]carbamate, methyl 5-(isopentyloxy)-1H-benzimidazol-2-ylcarbamate, Methyl N-[6-(3-methylbutoxy)-1H-benzoimidazol-2-yl]carbamate
| Molecular Formula | C14H19N3O3 |
|---|---|
| Molecular Weight | 277.14 g/mol |
| LogP | 3.1661 |
| Topological Polar Surface Area | 76.24 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 277.14264 |
| Heavy Atoms | 20 |
| Complexity | 592.3617 |
Chemical Identifiers
| CAS Number | 352225-80-0 |
|---|---|
| SMILES | CC(C)CCOC1=CC2=C(C=C1)N=C(N2)NC(=O)OC |
Product Overview
methyl N-[5-(isopentyloxy)-1H-1,3-benzimidazol-2-yl]carbamate (CAS 352225-80-0), with molecular formula C14H19N3O3 and molecular weight 277.14 g/mol. IUPAC: methyl N-[6-(3-methylbutoxy)-1H-benzimidazol-2-yl]carbamate.
Chemical Property Profile of methyl N-[5-(isopentyloxy)-1H-1,3-benzimidazol-2-yl]carbamate
Property Insights of methyl N-[5-(isopentyloxy)-1H-1,3-benzimidazol-2-yl]carbamate
The XLogP value of 3.1661 indicates that methyl N-[5-(isopentyloxy)-1H-1,3-benzimidazol-2-yl]carbamate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 76.24 Ų falls within the moderate polarity range, balancing permeability and solubility for methyl N-[5-(isopentyloxy)-1H-1,3-benzimidazol-2-yl]carbamate. Following Lipinski's Rule of Five, methyl N-[5-(isopentyloxy)-1H-1,3-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 N-[5-(isopentyloxy)-1H-1,3-benzimidazol-2-yl]carbamate?
The CAS number of methyl N-[5-(isopentyloxy)-1H-1,3-benzimidazol-2-yl]carbamate is 352225-80-0.
What is the molecular formula of methyl N-[5-(isopentyloxy)-1H-1,3-benzimidazol-2-yl]carbamate?
The molecular formula of methyl N-[5-(isopentyloxy)-1H-1,3-benzimidazol-2-yl]carbamate is C14H19N3O3.
What is the molecular weight of methyl N-[5-(isopentyloxy)-1H-1,3-benzimidazol-2-yl]carbamate?
The molecular weight of methyl N-[5-(isopentyloxy)-1H-1,3-benzimidazol-2-yl]carbamate is 277.14 g/mol.
Where can I buy methyl N-[5-(isopentyloxy)-1H-1,3-benzimidazol-2-yl]carbamate?
You can request a quote for methyl N-[5-(isopentyloxy)-1H-1,3-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 N-[5-(isopentyloxy)-1H-1,3-benzimidazol-2-yl]carbamate?
Yes, KEHONG BIO provides custom synthesis services for methyl N-[5-(isopentyloxy)-1H-1,3-benzimidazol-2-yl]carbamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.