AB00117415-01
TL;DR: AB00117415-01 (CAS 432004-79-0) is a chemical compound with molecular formula C29H20N2O6 and molecular weight 492.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[4-(9,11-dioxo-6,7,8,10-tetrahydro-5H-indeno[1,2-b]quinolin-10-yl)phenyl] 4-nitrobenzoate
Also Known As: AB00117415-01, 4-(9,11-dioxo-6,7,8,9,10,11-hexahydro-5H-indeno[1,2-b]quinolin-10-yl)phenyl 4-nitrobenzoate, 4-(1,10-dioxo-2,3,4,5,11-pentahydroindeno[3,2-b]quinolin-11-yl)phenyl 4-nitrob enzoate, [4-(9,11-dioxo-6,7,8,10-tetrahydro-5H-indeno[1,2-b]quinolin-10-yl)phenyl] 4-nitrobenzoate, 4-{9,11-DIOXO-5H,6H,7H,8H,9H,10H,11H-INDENO[1,2-B]QUINOLIN-10-YL}PHENYL 4-NITROBENZOATE
| Molecular Formula | C29H20N2O6 |
|---|---|
| Molecular Weight | 492.13 g/mol |
| LogP | 5.1155 |
| Topological Polar Surface Area | 115.61 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 492.13214 |
| Heavy Atoms | 37 |
| Complexity | 1564.6349 |
Chemical Identifiers
| CAS Number | 432004-79-0 |
|---|---|
| SMILES | C1CC2=C(C(C3=C(N2)C4=CC=CC=C4C3=O)C5=CC=C(C=C5)OC(=O)C6=CC=C(C=C6)[N+](=O)[O-])C(=O)C1 |
Product Overview
AB00117415-01 (CAS 432004-79-0), with molecular formula C29H20N2O6 and molecular weight 492.13 g/mol. IUPAC: [4-(9,11-dioxo-6,7,8,10-tetrahydro-5H-indeno[1,2-b]quinolin-10-yl)phenyl] 4-nitrobenzoate.
Chemical Property Profile of AB00117415-01
Property Insights of AB00117415-01
The XLogP value of 5.1155 indicates that AB00117415-01 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 115.61 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00117415-01. Following Lipinski's Rule of Five, AB00117415-01 has 1 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of AB00117415-01?
The CAS number of AB00117415-01 is 432004-79-0.
What is the molecular formula of AB00117415-01?
The molecular formula of AB00117415-01 is C29H20N2O6.
What is the molecular weight of AB00117415-01?
The molecular weight of AB00117415-01 is 492.13 g/mol.
Where can I buy AB00117415-01?
You can request a quote for AB00117415-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00117415-01?
Yes, KEHONG BIO provides custom synthesis services for AB00117415-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.