A3860/0163967
TL;DR: A3860/0163967 (CAS 728026-89-9) is a chemical compound with molecular formula C21H26N4O7S2 and molecular weight 510.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-[4-(4-methoxy-2-nitrophenyl)piperazin-1-yl]sulfonyl-1-methylsulfonyl-3,4-dihydro-2H-quinoline
Also Known As: A3860/0163967, 6-[4-(4-methoxy-2-nitrophenyl)piperazin-1-yl]sulfonyl-1-methylsulfonyl-3,4-dihydro-2H-quinoline, 6-{[4-(4-methoxy-2-nitrophenyl)piperazin-1-yl]sulfonyl}-1-(methylsulfonyl)-1,2,3,4-tetrahydroquinoline, 4-(4-METHOXY-2-NITROPHENYL)PIPERAZINO [1-(METHYLSULFONYL)-1,2,3,4-TETRAHYDRO-6-QUINOLINYL] SULFONE
| Molecular Formula | C21H26N4O7S2 |
|---|---|
| Molecular Weight | 510.12 g/mol |
| LogP | 1.8265 |
| Topological Polar Surface Area | 130.37 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 6 |
| Exact Mass | 510.1243 |
| Heavy Atoms | 34 |
| Complexity | 1320.6273 |
Chemical Identifiers
| CAS Number | 728026-89-9 |
|---|---|
| SMILES | COC1=CC(=C(C=C1)N2CCN(CC2)S(=O)(=O)C3=CC4=C(C=C3)N(CCC4)S(=O)(=O)C)[N+](=O)[O-] |
Product Overview
A3860/0163967 (CAS 728026-89-9), with molecular formula C21H26N4O7S2 and molecular weight 510.12 g/mol. IUPAC: 6-[4-(4-methoxy-2-nitrophenyl)piperazin-1-yl]sulfonyl-1-methylsulfonyl-3,4-dihydro-2H-quinoline.
Chemical Property Profile of A3860/0163967
Property Insights of A3860/0163967
The XLogP value of 1.8265 suggests moderate lipophilicity, balancing water solubility and membrane permeability for A3860/0163967. The TPSA of 130.37 Ų falls within the moderate polarity range, balancing permeability and solubility for A3860/0163967. Following Lipinski's Rule of Five, A3860/0163967 has 0 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of A3860/0163967?
The CAS number of A3860/0163967 is 728026-89-9.
What is the molecular formula of A3860/0163967?
The molecular formula of A3860/0163967 is C21H26N4O7S2.
What is the molecular weight of A3860/0163967?
The molecular weight of A3860/0163967 is 510.12 g/mol.
Where can I buy A3860/0163967?
You can request a quote for A3860/0163967 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for A3860/0163967?
Yes, KEHONG BIO provides custom synthesis services for A3860/0163967 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.