V86BFN25HA
TL;DR: V86BFN25HA (CAS 178870-06-9) is a chemical compound with molecular formula C20H19ClFNO2S and molecular weight 391.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
cyclohexyl 2-chloro-5-[(2-fluorobenzenecarbothioyl)amino]benzoate
Also Known As: Benzcarbothioanilide deriv., Benzoic acid, cyclohexyl ester, Benzoic acid, 2-chloro-5-(((2-fluorophenyl)thioxomethyl)amino)-, cyclohexyl ester, Cyclohexyl 2-chloro-5-(((2-fluorophenyl)thioxomethyl)amino)benzoate, cyclohexyl 2-chloro-5-[(2-fluorobenzenecarbothioyl)amino]benzoate
| Molecular Formula | C20H19ClFNO2S |
|---|---|
| Molecular Weight | 391.08 g/mol |
| LogP | 5.7562 |
| Topological Polar Surface Area | 38.33 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 391.0809 |
| Heavy Atoms | 26 |
| Complexity | 821.2085 |
Chemical Identifiers
| CAS Number | 178870-06-9 |
|---|---|
| SMILES | C1CCC(CC1)OC(=O)C2=C(C=CC(=C2)NC(=S)C3=CC=CC=C3F)Cl |
Product Overview
V86BFN25HA (CAS 178870-06-9), with molecular formula C20H19ClFNO2S and molecular weight 391.08 g/mol. IUPAC: cyclohexyl 2-chloro-5-[(2-fluorobenzenecarbothioyl)amino]benzoate.
Chemical Property Profile of V86BFN25HA
Property Insights of V86BFN25HA
The XLogP value of 5.7562 indicates that V86BFN25HA is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 38.33 Ų, V86BFN25HA exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, V86BFN25HA has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of V86BFN25HA?
The CAS number of V86BFN25HA is 178870-06-9.
What is the molecular formula of V86BFN25HA?
The molecular formula of V86BFN25HA is C20H19ClFNO2S.
What is the molecular weight of V86BFN25HA?
The molecular weight of V86BFN25HA is 391.08 g/mol.
Where can I buy V86BFN25HA?
You can request a quote for V86BFN25HA directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for V86BFN25HA?
Yes, KEHONG BIO provides custom synthesis services for V86BFN25HA and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.