BAS 00462481
TL;DR: BAS 00462481 (CAS 312758-74-0) is a chemical compound with molecular formula C22H16BrClN2O2 and molecular weight 454.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-benzoyl-7-bromo-5-(2-chlorophenyl)-3,5-dihydro-1H-1,4-benzodiazepin-2-one
Also Known As: BAS 00462481, AB00666828-01, 4-benzoyl-7-bromo-5-(2-chlorophenyl)-1,3,4,5-tetrahydro-2H-1,4-benzodiazepin-2-one, AH-034/11365822, 4-benzoyl-7-bromo-5-(2-chlorophenyl)-3,5-dihydro-1H-1,4-benzodiazepin-2-one
| Molecular Formula | C22H16BrClN2O2 |
|---|---|
| Molecular Weight | 454.01 g/mol |
| LogP | 5.2864 |
| Topological Polar Surface Area | 49.41 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 454.00836 |
| Heavy Atoms | 28 |
| Complexity | 1055.4122 |
Chemical Identifiers
| CAS Number | 312758-74-0 |
|---|---|
| SMILES | C1C(=O)NC2=C(C=C(C=C2)Br)C(N1C(=O)C3=CC=CC=C3)C4=CC=CC=C4Cl |
Product Overview
BAS 00462481 (CAS 312758-74-0), with molecular formula C22H16BrClN2O2 and molecular weight 454.01 g/mol. IUPAC: 4-benzoyl-7-bromo-5-(2-chlorophenyl)-3,5-dihydro-1H-1,4-benzodiazepin-2-one.
Chemical Property Profile of BAS 00462481
Property Insights of BAS 00462481
The XLogP value of 5.2864 indicates that BAS 00462481 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 49.41 Ų, BAS 00462481 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BAS 00462481 has 1 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of BAS 00462481?
The CAS number of BAS 00462481 is 312758-74-0.
What is the molecular formula of BAS 00462481?
The molecular formula of BAS 00462481 is C22H16BrClN2O2.
What is the molecular weight of BAS 00462481?
The molecular weight of BAS 00462481 is 454.01 g/mol.
Where can I buy BAS 00462481?
You can request a quote for BAS 00462481 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00462481?
Yes, KEHONG BIO provides custom synthesis services for BAS 00462481 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.