![methyl 2-(3-(4-chlorobenzyl)-2-imino-2,3-dihydro-1H-benzo[d]imidazol-1-yl)acetate hydrobromide structure](/static/products/470/470471-18-2.png)
methyl 2-(3-(4-chlorobenzyl)-2-imino-2,3-dihydro-1H-benzo[d]imidazol-1-yl)acetate hydrobromide
TL;DR: methyl 2-(3-(4-chlorobenzyl)-2-imino-2,3-dihydro-1H-benzo[d]imidazol-1-yl)acetate hydrobromide (CAS 470471-18-2) is a chemical compound with molecular formula C17H17BrClN3O2 and molecular weight 409.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-[3-[(4-chlorophenyl)methyl]-2-iminobenzimidazol-1-yl]acetate;hydrobromide
Also Known As: methyl 2-(3-(4-chlorobenzyl)-2-imino-2,3-dihydro-1H-benzo[d]imidazol-1-yl)acetate hydrobromide, Methyl 2-[3-[(4-chlorophenyl)methyl]-2-imino-benzoimidazol-1-yl]acetate Hydrobromide, methyl 2-[3-[(4-chlorophenyl)methyl]-2-iminobenzimidazol-1-yl]acetate hydrobromide
| Molecular Formula | C17H17BrClN3O2 |
|---|---|
| Molecular Weight | 409.02 g/mol |
| LogP | 3.37487 |
| Topological Polar Surface Area | 60.01 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 409.01926 |
| Heavy Atoms | 24 |
| Complexity | 915.7255 |
Chemical Identifiers
| CAS Number | 470471-18-2 |
|---|---|
| SMILES | COC(=O)CN1C2=CC=CC=C2N(C1=N)CC3=CC=C(C=C3)Cl.Br |
Product Overview
methyl 2-(3-(4-chlorobenzyl)-2-imino-2,3-dihydro-1H-benzo[d]imidazol-1-yl)acetate hydrobromide (CAS 470471-18-2), with molecular formula C17H17BrClN3O2 and molecular weight 409.02 g/mol. IUPAC: methyl 2-[3-[(4-chlorophenyl)methyl]-2-iminobenzimidazol-1-yl]acetate;hydrobromide.
Chemical Property Profile of methyl 2-(3-(4-chlorobenzyl)-2-imino-2,3-dihydro-1H-benzo[d]imidazol-1-yl)acetate hydrobromide
Property Insights of methyl 2-(3-(4-chlorobenzyl)-2-imino-2,3-dihydro-1H-benzo[d]imidazol-1-yl)acetate hydrobromide
The XLogP value of 3.37487 indicates that methyl 2-(3-(4-chlorobenzyl)-2-imino-2,3-dihydro-1H-benzo[d]imidazol-1-yl)acetate hydrobromide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 60.01 Ų falls within the moderate polarity range, balancing permeability and solubility for methyl 2-(3-(4-chlorobenzyl)-2-imino-2,3-dihydro-1H-benzo[d]imidazol-1-yl)acetate hydrobromide. Following Lipinski's Rule of Five, methyl 2-(3-(4-chlorobenzyl)-2-imino-2,3-dihydro-1H-benzo[d]imidazol-1-yl)acetate hydrobromide has 1 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 methyl 2-(3-(4-chlorobenzyl)-2-imino-2,3-dihydro-1H-benzo[d]imidazol-1-yl)acetate hydrobromide?
The CAS number of methyl 2-(3-(4-chlorobenzyl)-2-imino-2,3-dihydro-1H-benzo[d]imidazol-1-yl)acetate hydrobromide is 470471-18-2.
What is the molecular formula of methyl 2-(3-(4-chlorobenzyl)-2-imino-2,3-dihydro-1H-benzo[d]imidazol-1-yl)acetate hydrobromide?
The molecular formula of methyl 2-(3-(4-chlorobenzyl)-2-imino-2,3-dihydro-1H-benzo[d]imidazol-1-yl)acetate hydrobromide is C17H17BrClN3O2.
What is the molecular weight of methyl 2-(3-(4-chlorobenzyl)-2-imino-2,3-dihydro-1H-benzo[d]imidazol-1-yl)acetate hydrobromide?
The molecular weight of methyl 2-(3-(4-chlorobenzyl)-2-imino-2,3-dihydro-1H-benzo[d]imidazol-1-yl)acetate hydrobromide is 409.02 g/mol.
Where can I buy methyl 2-(3-(4-chlorobenzyl)-2-imino-2,3-dihydro-1H-benzo[d]imidazol-1-yl)acetate hydrobromide?
You can request a quote for methyl 2-(3-(4-chlorobenzyl)-2-imino-2,3-dihydro-1H-benzo[d]imidazol-1-yl)acetate hydrobromide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for methyl 2-(3-(4-chlorobenzyl)-2-imino-2,3-dihydro-1H-benzo[d]imidazol-1-yl)acetate hydrobromide?
Yes, KEHONG BIO provides custom synthesis services for methyl 2-(3-(4-chlorobenzyl)-2-imino-2,3-dihydro-1H-benzo[d]imidazol-1-yl)acetate hydrobromide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.