AB00571274-02
TL;DR: AB00571274-02 (CAS 533877-35-9) is a chemical compound with molecular formula C25H16BrFN2O4 and molecular weight 506.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-bromo-5-(4-fluorophenyl)-4-(2-oxochromene-3-carbonyl)-3,5-dihydro-1H-1,4-benzodiazepin-2-one
Also Known As: AB00571274-02, F0560-0551, 7-bromo-5-(4-fluorophenyl)-4-(2-oxo-2H-chromene-3-carbonyl)-2,3,4,5-tetrahydro-1H-1,4-benzodiazepin-2-one, 7-bromo-5-(4-fluorophenyl)-4-(2-oxo-2H-chromene-3-carbonyl)-4,5-dihydro-1H-benzo[e][1,4]diazepin-2(3H)-one, 7-bromo-5-(4-fluorophenyl)-4-(2-oxochromene-3-carbonyl)-3,5-dihydro-1H-1,4-benzodiazepin-2-one
| Molecular Formula | C25H16BrFN2O4 |
|---|---|
| Molecular Weight | 506.03 g/mol |
| LogP | 4.8785 |
| Topological Polar Surface Area | 79.62 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 506.02774 |
| Heavy Atoms | 33 |
| Complexity | 1465.7538 |
Chemical Identifiers
| CAS Number | 533877-35-9 |
|---|---|
| SMILES | C1C(=O)NC2=C(C=C(C=C2)Br)C(N1C(=O)C3=CC4=CC=CC=C4OC3=O)C5=CC=C(C=C5)F |
Product Overview
AB00571274-02 (CAS 533877-35-9), with molecular formula C25H16BrFN2O4 and molecular weight 506.03 g/mol. IUPAC: 7-bromo-5-(4-fluorophenyl)-4-(2-oxochromene-3-carbonyl)-3,5-dihydro-1H-1,4-benzodiazepin-2-one.
Chemical Property Profile of AB00571274-02
Property Insights of AB00571274-02
The XLogP value of 4.8785 indicates that AB00571274-02 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 79.62 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00571274-02. Following Lipinski's Rule of Five, AB00571274-02 has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of AB00571274-02?
The CAS number of AB00571274-02 is 533877-35-9.
What is the molecular formula of AB00571274-02?
The molecular formula of AB00571274-02 is C25H16BrFN2O4.
What is the molecular weight of AB00571274-02?
The molecular weight of AB00571274-02 is 506.03 g/mol.
Where can I buy AB00571274-02?
You can request a quote for AB00571274-02 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00571274-02?
Yes, KEHONG BIO provides custom synthesis services for AB00571274-02 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.