F1183-0085
TL;DR: F1183-0085 (CAS 380461-89-2) is a chemical compound with molecular formula C27H26ClN3O3S and molecular weight 507.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 4-(2-chlorophenyl)-5-cyano-6-[2-(3,4-dihydro-2H-quinolin-1-yl)-2-oxoethyl]sulfanyl-2-methyl-1,4-dihydropyridine-3-carboxylate
Also Known As: F1183-0085, ethyl 4-(2-chlorophenyl)-5-cyano-2-methyl-6-{[2-oxo-2-(1,2,3,4-tetrahydroquinolin-1-yl)ethyl]sulfanyl}-1,4-dihydropyridine-3-carboxylate, ethyl 4-(2-chlorophenyl)-5-cyano-6-((2-(3,4-dihydroquinolin-1(2H)-yl)-2-oxoethyl)thio)-2-methyl-1,4-dihydropyridine-3-carboxylate, ethyl 4-(2-chlorophenyl)-5-cyano-6-[2-(3,4-dihydro-2H-quinolin-1-yl)-2-oxoethyl]sulfanyl-2-methyl-1,4-dihydropyridine-3-carboxylate, ethyl 4-(2-chlorophenyl)-5-cyano-6-{[2-(3,4-dihydroquinolin-1(2H)-yl)-2-oxoethyl]sulfanyl}-2-methyl-1,4-dihydropyridine-3-carboxylate
| Molecular Formula | C27H26ClN3O3S |
|---|---|
| Molecular Weight | 507.14 g/mol |
| LogP | 5.31168 |
| Topological Polar Surface Area | 82.43 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 507.13834 |
| Heavy Atoms | 35 |
| Complexity | 1264.313 |
Chemical Identifiers
| CAS Number | 380461-89-2 |
|---|---|
| SMILES | CCOC(=O)C1=C(NC(=C(C1C2=CC=CC=C2Cl)C#N)SCC(=O)N3CCCC4=CC=CC=C43)C |
Product Overview
F1183-0085 (CAS 380461-89-2), with molecular formula C27H26ClN3O3S and molecular weight 507.14 g/mol. IUPAC: ethyl 4-(2-chlorophenyl)-5-cyano-6-[2-(3,4-dihydro-2H-quinolin-1-yl)-2-oxoethyl]sulfanyl-2-methyl-1,4-dihydropyridine-3-carboxylate.
Chemical Property Profile of F1183-0085
Property Insights of F1183-0085
The XLogP value of 5.31168 indicates that F1183-0085 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 82.43 Ų falls within the moderate polarity range, balancing permeability and solubility for F1183-0085. Following Lipinski's Rule of Five, F1183-0085 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 F1183-0085?
The CAS number of F1183-0085 is 380461-89-2.
What is the molecular formula of F1183-0085?
The molecular formula of F1183-0085 is C27H26ClN3O3S.
What is the molecular weight of F1183-0085?
The molecular weight of F1183-0085 is 507.14 g/mol.
Where can I buy F1183-0085?
You can request a quote for F1183-0085 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F1183-0085?
Yes, KEHONG BIO provides custom synthesis services for F1183-0085 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.