3-Bromo-4-phenyl-1,3-dihydro-2h-1,5-benzodiazepin-2-one
TL;DR: 3-Bromo-4-phenyl-1,3-dihydro-2h-1,5-benzodiazepin-2-one (CAS 66752-03-2) is a chemical compound with molecular formula C15H11BrN2O and molecular weight 314.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-bromo-4-phenyl-1,3-dihydro-1,5-benzodiazepin-2-one
Also Known As: 3-Bromo-4-phenyl-1,3-dihydro-2h-1,5-benzodiazepin-2-one, BAS 01392466, 3-bromo-4-phenyl-1,3-dihydro-1,5-benzodiazepin-2-one, J1.641.523E, 3-bromo-4-phenyl-2,3-dihydro-1h-1,5-benzodiazepin-2-one
| Molecular Formula | C15H11BrN2O |
|---|---|
| Molecular Weight | 314.01 g/mol |
| LogP | 3.523 |
| Topological Polar Surface Area | 41.46 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 314.0055 |
| Heavy Atoms | 19 |
| Complexity | 652.20496 |
Chemical Identifiers
| CAS Number | 66752-03-2 |
|---|---|
| SMILES | C1=CC=C(C=C1)C2=NC3=CC=CC=C3NC(=O)C2Br |
Product Overview
3-Bromo-4-phenyl-1,3-dihydro-2h-1,5-benzodiazepin-2-one (CAS 66752-03-2), with molecular formula C15H11BrN2O and molecular weight 314.01 g/mol. IUPAC: 3-bromo-4-phenyl-1,3-dihydro-1,5-benzodiazepin-2-one.
Chemical Property Profile of 3-Bromo-4-phenyl-1,3-dihydro-2h-1,5-benzodiazepin-2-one
Property Insights of 3-Bromo-4-phenyl-1,3-dihydro-2h-1,5-benzodiazepin-2-one
The XLogP value of 3.523 indicates that 3-Bromo-4-phenyl-1,3-dihydro-2h-1,5-benzodiazepin-2-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 41.46 Ų, 3-Bromo-4-phenyl-1,3-dihydro-2h-1,5-benzodiazepin-2-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Bromo-4-phenyl-1,3-dihydro-2h-1,5-benzodiazepin-2-one has 1 hydrogen bond donor(s) and 2 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 3-Bromo-4-phenyl-1,3-dihydro-2h-1,5-benzodiazepin-2-one?
The CAS number of 3-Bromo-4-phenyl-1,3-dihydro-2h-1,5-benzodiazepin-2-one is 66752-03-2.
What is the molecular formula of 3-Bromo-4-phenyl-1,3-dihydro-2h-1,5-benzodiazepin-2-one?
The molecular formula of 3-Bromo-4-phenyl-1,3-dihydro-2h-1,5-benzodiazepin-2-one is C15H11BrN2O.
What is the molecular weight of 3-Bromo-4-phenyl-1,3-dihydro-2h-1,5-benzodiazepin-2-one?
The molecular weight of 3-Bromo-4-phenyl-1,3-dihydro-2h-1,5-benzodiazepin-2-one is 314.01 g/mol.
Where can I buy 3-Bromo-4-phenyl-1,3-dihydro-2h-1,5-benzodiazepin-2-one?
You can request a quote for 3-Bromo-4-phenyl-1,3-dihydro-2h-1,5-benzodiazepin-2-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Bromo-4-phenyl-1,3-dihydro-2h-1,5-benzodiazepin-2-one?
Yes, KEHONG BIO provides custom synthesis services for 3-Bromo-4-phenyl-1,3-dihydro-2h-1,5-benzodiazepin-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.