AB00668434-01
TL;DR: AB00668434-01 (CAS 533880-69-2) is a chemical compound with molecular formula C28H22F2N2O3 and molecular weight 472.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(2-ethoxynaphthalene-1-carbonyl)-7-fluoro-5-(4-fluorophenyl)-3,5-dihydro-1H-1,4-benzodiazepin-2-one
Also Known As: AB00668434-01, F0560-0914, 4-(2-ethoxy-1-naphthoyl)-7-fluoro-5-(4-fluorophenyl)-4,5-dihydro-1H-benzo[e][1,4]diazepin-2(3H)-one, 4-(2-ethoxynaphthalene-1-carbonyl)-7-fluoro-5-(4-fluorophenyl)-2,3,4,5-tetrahydro-1H-1,4-benzodiazepin-2-one, 4-(2-ethoxynaphthalene-1-carbonyl)-7-fluoro-5-(4-fluorophenyl)-3,5-dihydro-1H-1,4-benzodiazepin-2-one
| Molecular Formula | C28H22F2N2O3 |
|---|---|
| Molecular Weight | 472.16 g/mol |
| LogP | 5.7006 |
| Topological Polar Surface Area | 58.64 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 472.15985 |
| Heavy Atoms | 35 |
| Complexity | 1436.3494 |
Chemical Identifiers
| CAS Number | 533880-69-2 |
|---|---|
| SMILES | CCOC1=C(C2=CC=CC=C2C=C1)C(=O)N3CC(=O)NC4=C(C3C5=CC=C(C=C5)F)C=C(C=C4)F |
Product Overview
AB00668434-01 (CAS 533880-69-2), with molecular formula C28H22F2N2O3 and molecular weight 472.16 g/mol. IUPAC: 4-(2-ethoxynaphthalene-1-carbonyl)-7-fluoro-5-(4-fluorophenyl)-3,5-dihydro-1H-1,4-benzodiazepin-2-one.
Chemical Property Profile of AB00668434-01
Property Insights of AB00668434-01
The XLogP value of 5.7006 indicates that AB00668434-01 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 58.64 Ų, AB00668434-01 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, AB00668434-01 has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of AB00668434-01?
The CAS number of AB00668434-01 is 533880-69-2.
What is the molecular formula of AB00668434-01?
The molecular formula of AB00668434-01 is C28H22F2N2O3.
What is the molecular weight of AB00668434-01?
The molecular weight of AB00668434-01 is 472.16 g/mol.
Where can I buy AB00668434-01?
You can request a quote for AB00668434-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00668434-01?
Yes, KEHONG BIO provides custom synthesis services for AB00668434-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.