N-Methylbenzimidoyl bromide
TL;DR: N-Methylbenzimidoyl bromide (CAS 41182-85-8) is a chemical compound with molecular formula C8H8BrN and molecular weight 196.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-methylbenzenecarboximidoyl bromide
Also Known As: N-Methylbenzimidoyl bromide, N-Methylbenzimidoylbromide, N-methylbenzenecarbonimidoyl bromide, N-methylbenzenecarboximidoyl bromide, Benzenecarboximidoyl bromide, N-methyl-
| Molecular Formula | C8H8BrN |
|---|---|
| Molecular Weight | 196.98 g/mol |
| LogP | 2.7 |
| Topological Polar Surface Area | 12.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 196.98401 |
| Heavy Atoms | 10 |
| Complexity | 125.0 |
Chemical Identifiers
| CAS Number | 41182-85-8 |
|---|---|
| SMILES | CN=C(C1=CC=CC=C1)Br |
| InChIKey | FHMAZKPNPHKQJO-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
N-Methylbenzimidoyl bromide (CAS 41182-85-8), with molecular formula C8H8BrN and molecular weight 196.98 g/mol. IUPAC: N-methylbenzenecarboximidoyl bromide.
Chemical Property Profile of N-Methylbenzimidoyl bromide
Property Insights of N-Methylbenzimidoyl bromide
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-Methylbenzimidoyl bromide. With a topological polar surface area (TPSA) of 12.4 Ų, N-Methylbenzimidoyl bromide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-Methylbenzimidoyl bromide has 0 hydrogen bond donor(s) and 1 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-Methylbenzimidoyl bromide?
The CAS number of N-Methylbenzimidoyl bromide is 41182-85-8.
What is the molecular formula of N-Methylbenzimidoyl bromide?
The molecular formula of N-Methylbenzimidoyl bromide is C8H8BrN.
What is the molecular weight of N-Methylbenzimidoyl bromide?
The molecular weight of N-Methylbenzimidoyl bromide is 196.98 g/mol.
Where can I buy N-Methylbenzimidoyl bromide?
You can request a quote for N-Methylbenzimidoyl bromide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-Methylbenzimidoyl bromide?
Yes, KEHONG BIO provides custom synthesis services for N-Methylbenzimidoyl bromide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.