TimTec1_006184
TL;DR: TimTec1_006184 (CAS 633284-94-3) is a chemical compound with molecular formula C18H21FN4O3S and molecular weight 392.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-ethyl-6-fluoro-7-[4-(methylcarbamothioyl)piperazin-1-yl]-4-oxoquinoline-3-carboxylic acid
Also Known As: TimTec1_006184, KSC-4-35, A3278/0139448, 1-ethyl-6-fluoro-7-[4-(methylcarbamothioyl)piperazin-1-yl]-4-oxo-1,4-dihydroquinoline-3-carboxylic acid, 1-ethyl-6-fluoro-7-[4-(methylcarbamothioyl)piperazin-1-yl]-4-oxoquinoline-3-carboxylic acid
| Molecular Formula | C18H21FN4O3S |
|---|---|
| Molecular Weight | 392.13 g/mol |
| LogP | 1.485 |
| Topological Polar Surface Area | 77.81 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 392.13184 |
| Heavy Atoms | 27 |
| Complexity | 967.21356 |
Chemical Identifiers
| CAS Number | 633284-94-3 |
|---|---|
| SMILES | CCN1C=C(C(=O)C2=CC(=C(C=C21)N3CCN(CC3)C(=S)NC)F)C(=O)O |
Product Overview
TimTec1_006184 (CAS 633284-94-3), with molecular formula C18H21FN4O3S and molecular weight 392.13 g/mol. IUPAC: 1-ethyl-6-fluoro-7-[4-(methylcarbamothioyl)piperazin-1-yl]-4-oxoquinoline-3-carboxylic acid.
Chemical Property Profile of TimTec1_006184
Property Insights of TimTec1_006184
The XLogP value of 1.485 suggests moderate lipophilicity, balancing water solubility and membrane permeability for TimTec1_006184. The TPSA of 77.81 Ų falls within the moderate polarity range, balancing permeability and solubility for TimTec1_006184. Following Lipinski's Rule of Five, TimTec1_006184 has 2 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 TimTec1_006184?
The CAS number of TimTec1_006184 is 633284-94-3.
What is the molecular formula of TimTec1_006184?
The molecular formula of TimTec1_006184 is C18H21FN4O3S.
What is the molecular weight of TimTec1_006184?
The molecular weight of TimTec1_006184 is 392.13 g/mol.
Where can I buy TimTec1_006184?
You can request a quote for TimTec1_006184 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for TimTec1_006184?
Yes, KEHONG BIO provides custom synthesis services for TimTec1_006184 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.