Cyclopentyl 2-chloro-5-[(2-methylfuran-3-carbothioyl)amino]benzoate
TL;DR: Cyclopentyl 2-chloro-5-[(2-methylfuran-3-carbothioyl)amino]benzoate (CAS 165391-83-3) is a chemical compound with molecular formula C18H18ClNO3S and molecular weight 363.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
cyclopentyl 2-chloro-5-[(2-methylfuran-3-carbothioyl)amino]benzoate
Also Known As: UC42, UC 42, Furancarbothioanilide deriv., Benzoic acid, cyclopentyl ester, cyclopentyl 2-chloro-5-[(2-methylfuran-3-carbothioyl)amino]benzoate
| Molecular Formula | C18H18ClNO3S |
|---|---|
| Molecular Weight | 363.07 g/mol |
| LogP | 5.12842 |
| Topological Polar Surface Area | 51.47 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 363.06958 |
| Heavy Atoms | 24 |
| Complexity | 765.3744 |
Chemical Identifiers
| CAS Number | 165391-83-3 |
|---|---|
| SMILES | CC1=C(C=CO1)C(=S)NC2=CC(=C(C=C2)Cl)C(=O)OC3CCCC3 |
Product Overview
Cyclopentyl 2-chloro-5-[(2-methylfuran-3-carbothioyl)amino]benzoate (CAS 165391-83-3), with molecular formula C18H18ClNO3S and molecular weight 363.07 g/mol. IUPAC: cyclopentyl 2-chloro-5-[(2-methylfuran-3-carbothioyl)amino]benzoate.
Chemical Property Profile of Cyclopentyl 2-chloro-5-[(2-methylfuran-3-carbothioyl)amino]benzoate
Property Insights of Cyclopentyl 2-chloro-5-[(2-methylfuran-3-carbothioyl)amino]benzoate
The XLogP value of 5.12842 indicates that Cyclopentyl 2-chloro-5-[(2-methylfuran-3-carbothioyl)amino]benzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 51.47 Ų, Cyclopentyl 2-chloro-5-[(2-methylfuran-3-carbothioyl)amino]benzoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Cyclopentyl 2-chloro-5-[(2-methylfuran-3-carbothioyl)amino]benzoate has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Cyclopentyl 2-chloro-5-[(2-methylfuran-3-carbothioyl)amino]benzoate?
The CAS number of Cyclopentyl 2-chloro-5-[(2-methylfuran-3-carbothioyl)amino]benzoate is 165391-83-3.
What is the molecular formula of Cyclopentyl 2-chloro-5-[(2-methylfuran-3-carbothioyl)amino]benzoate?
The molecular formula of Cyclopentyl 2-chloro-5-[(2-methylfuran-3-carbothioyl)amino]benzoate is C18H18ClNO3S.
What is the molecular weight of Cyclopentyl 2-chloro-5-[(2-methylfuran-3-carbothioyl)amino]benzoate?
The molecular weight of Cyclopentyl 2-chloro-5-[(2-methylfuran-3-carbothioyl)amino]benzoate is 363.07 g/mol.
Where can I buy Cyclopentyl 2-chloro-5-[(2-methylfuran-3-carbothioyl)amino]benzoate?
You can request a quote for Cyclopentyl 2-chloro-5-[(2-methylfuran-3-carbothioyl)amino]benzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Cyclopentyl 2-chloro-5-[(2-methylfuran-3-carbothioyl)amino]benzoate?
Yes, KEHONG BIO provides custom synthesis services for Cyclopentyl 2-chloro-5-[(2-methylfuran-3-carbothioyl)amino]benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.