AB00916760-05
TL;DR: AB00916760-05 (CAS 898464-80-7) is a chemical compound with molecular formula C22H25N3O3S and molecular weight 411.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-(4-phenylpiperazin-1-yl)sulfonyl-1-azatricyclo[7.3.1.05,13]trideca-5,7,9(13)-trien-2-one
Also Known As: AB00916760-05, F2669-0151, 9-((4-phenylpiperazin-1-yl)sulfonyl)-1,2,6,7-tetrahydropyrido[3,2,1-ij]quinolin-3(5H)-one, 7-[(4-phenylpiperazin-1-yl)sulfonyl]-1-azatricyclo[7.3.1.0^{5,13}]trideca-5,7,9(13)-trien-2-one, 7-(4-phenylpiperazin-1-yl)sulfonyl-1-azatricyclo[7.3.1.05,13]trideca-5,7,9(13)-trien-2-one
| Molecular Formula | C22H25N3O3S |
|---|---|
| Molecular Weight | 411.16 g/mol |
| LogP | 2.4229 |
| Topological Polar Surface Area | 60.93 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 411.16165 |
| Heavy Atoms | 29 |
| Complexity | 1027.2222 |
Chemical Identifiers
| CAS Number | 898464-80-7 |
|---|---|
| SMILES | C1CC2=C3C(=CC(=C2)S(=O)(=O)N4CCN(CC4)C5=CC=CC=C5)CCC(=O)N3C1 |
Product Overview
AB00916760-05 (CAS 898464-80-7), with molecular formula C22H25N3O3S and molecular weight 411.16 g/mol. IUPAC: 7-(4-phenylpiperazin-1-yl)sulfonyl-1-azatricyclo[7.3.1.05,13]trideca-5,7,9(13)-trien-2-one.
Chemical Property Profile of AB00916760-05
Property Insights of AB00916760-05
The XLogP value of 2.4229 suggests moderate lipophilicity, balancing water solubility and membrane permeability for AB00916760-05. The TPSA of 60.93 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00916760-05. Following Lipinski's Rule of Five, AB00916760-05 has 0 hydrogen bond donor(s) and 4 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 AB00916760-05?
The CAS number of AB00916760-05 is 898464-80-7.
What is the molecular formula of AB00916760-05?
The molecular formula of AB00916760-05 is C22H25N3O3S.
What is the molecular weight of AB00916760-05?
The molecular weight of AB00916760-05 is 411.16 g/mol.
Where can I buy AB00916760-05?
You can request a quote for AB00916760-05 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00916760-05?
Yes, KEHONG BIO provides custom synthesis services for AB00916760-05 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.