N-Methylbromazepam
TL;DR: N-Methylbromazepam (CAS 1812-33-5) is a chemical compound with molecular formula C15H12BrN3O and molecular weight 329.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-bromo-1-methyl-5-pyridin-2-yl-3H-1,4-benzodiazepin-2-one
Also Known As: N-Methylbromazepam, N-Methyl bromoazepam, N1-Methyl Bromazepam, 7-bromo-1-methyl-5-pyridin-2-yl-3H-1,4-benzodiazepin-2-one, 2H-1,4-Benzodiazepin-2-one, 7-bromo-1,3-dihydro-1-methyl-5-(2-pyridinyl)-
| Molecular Formula | C15H12BrN3O |
|---|---|
| Molecular Weight | 329.02 g/mol |
| LogP | 1.9 |
| Topological Polar Surface Area | 45.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 329.01636 |
| Heavy Atoms | 20 |
| Complexity | 412.0 |
Chemical Identifiers
| CAS Number | 1812-33-5 |
|---|---|
| SMILES | CN1C(=O)CN=C(C2=C1C=CC(=C2)Br)C3=CC=CC=N3 |
| InChIKey | GIBKFDFZIZIKGJ-UHFFFAOYSA-N |
Product Overview
N-Methylbromazepam (CAS 1812-33-5), with molecular formula C15H12BrN3O and molecular weight 329.02 g/mol. IUPAC: 7-bromo-1-methyl-5-pyridin-2-yl-3H-1,4-benzodiazepin-2-one.
Chemical Property Profile of N-Methylbromazepam
Property Insights of N-Methylbromazepam
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-Methylbromazepam. With a topological polar surface area (TPSA) of 45.6 Ų, N-Methylbromazepam exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-Methylbromazepam has 0 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-Methylbromazepam?
The CAS number of N-Methylbromazepam is 1812-33-5.
What is the molecular formula of N-Methylbromazepam?
The molecular formula of N-Methylbromazepam is C15H12BrN3O.
What is the molecular weight of N-Methylbromazepam?
The molecular weight of N-Methylbromazepam is 329.02 g/mol.
Where can I buy N-Methylbromazepam?
You can request a quote for N-Methylbromazepam directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-Methylbromazepam?
Yes, KEHONG BIO provides custom synthesis services for N-Methylbromazepam and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.