MixCom6_000191
TL;DR: MixCom6_000191 (CAS 423126-72-1) is a chemical compound with molecular formula C24H25FN4O6S and molecular weight 516.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 4-[6-[(4-fluorophenyl)-methylsulfamoyl]-4-oxo-1H-quinoline-3-carbonyl]piperazine-1-carboxylate
Also Known As: MixCom6_000191, ChemDiv1_016031, Ethyl 4-[[6-[[(4-Fluorophenyl)methylamino]sulfonyl]-1,4-dihydro-4-oxo-3-quinolinyl]carbonyl]-1-piperazinecarboxylate, ethyl 4-[6-[(4-fluorophenyl)-methylsulfamoyl]-4-oxo-1H-quinoline-3-carbonyl]piperazine-1-carboxylate, ETHYL 4-{6-[(4-FLUOROPHENYL)(METHYL)SULFAMOYL]-4-OXO-1,4-DIHYDROQUINOLINE-3-CARBONYL}PIPERAZINE-1-CARBOXYLATE
| Molecular Formula | C24H25FN4O6S |
|---|---|
| Molecular Weight | 516.15 g/mol |
| LogP | 2.4066 |
| Topological Polar Surface Area | 120.09 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 516.1479 |
| Heavy Atoms | 36 |
| Complexity | 1464.2002 |
Chemical Identifiers
| CAS Number | 423126-72-1 |
|---|---|
| SMILES | CCOC(=O)N1CCN(CC1)C(=O)C2=CNC3=C(C2=O)C=C(C=C3)S(=O)(=O)N(C)C4=CC=C(C=C4)F |
Product Overview
MixCom6_000191 (CAS 423126-72-1), with molecular formula C24H25FN4O6S and molecular weight 516.15 g/mol. IUPAC: ethyl 4-[6-[(4-fluorophenyl)-methylsulfamoyl]-4-oxo-1H-quinoline-3-carbonyl]piperazine-1-carboxylate.
Chemical Property Profile of MixCom6_000191
Property Insights of MixCom6_000191
The XLogP value of 2.4066 suggests moderate lipophilicity, balancing water solubility and membrane permeability for MixCom6_000191. The TPSA of 120.09 Ų falls within the moderate polarity range, balancing permeability and solubility for MixCom6_000191. Following Lipinski's Rule of Five, MixCom6_000191 has 1 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of MixCom6_000191?
The CAS number of MixCom6_000191 is 423126-72-1.
What is the molecular formula of MixCom6_000191?
The molecular formula of MixCom6_000191 is C24H25FN4O6S.
What is the molecular weight of MixCom6_000191?
The molecular weight of MixCom6_000191 is 516.15 g/mol.
Where can I buy MixCom6_000191?
You can request a quote for MixCom6_000191 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for MixCom6_000191?
Yes, KEHONG BIO provides custom synthesis services for MixCom6_000191 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.