N-cyclohexylbenzenecarbothioamide
TL;DR: N-cyclohexylbenzenecarbothioamide (CAS 10220-98-1) is a chemical compound with molecular formula C13H17NS and molecular weight 219.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-cyclohexylbenzenecarbothioamide
Also Known As: N-cyclohexylbenzenecarbothioamide, N-Cyclohexylthiobenzamide, Benzenecarbothioamide, N-cyclohexyl-, N-cyclohexyl-benzenecarbothioamide, J1.780.227E
| Molecular Formula | C13H17NS |
|---|---|
| Molecular Weight | 219.11 g/mol |
| LogP | 3.2844 |
| Topological Polar Surface Area | 12.03 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 219.10817 |
| Heavy Atoms | 15 |
| Complexity | 314.56766 |
Chemical Identifiers
| CAS Number | 10220-98-1 |
|---|---|
| SMILES | C1CCC(CC1)NC(=S)C2=CC=CC=C2 |
Product Overview
N-cyclohexylbenzenecarbothioamide (CAS 10220-98-1), with molecular formula C13H17NS and molecular weight 219.11 g/mol. IUPAC: N-cyclohexylbenzenecarbothioamide.
Chemical Property Profile of N-cyclohexylbenzenecarbothioamide
Property Insights of N-cyclohexylbenzenecarbothioamide
The XLogP value of 3.2844 indicates that N-cyclohexylbenzenecarbothioamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 12.03 Ų, N-cyclohexylbenzenecarbothioamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-cyclohexylbenzenecarbothioamide has 1 hydrogen bond donor(s) and 1 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 N-cyclohexylbenzenecarbothioamide?
The CAS number of N-cyclohexylbenzenecarbothioamide is 10220-98-1.
What is the molecular formula of N-cyclohexylbenzenecarbothioamide?
The molecular formula of N-cyclohexylbenzenecarbothioamide is C13H17NS.
What is the molecular weight of N-cyclohexylbenzenecarbothioamide?
The molecular weight of N-cyclohexylbenzenecarbothioamide is 219.11 g/mol.
Where can I buy N-cyclohexylbenzenecarbothioamide?
You can request a quote for N-cyclohexylbenzenecarbothioamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-cyclohexylbenzenecarbothioamide?
Yes, KEHONG BIO provides custom synthesis services for N-cyclohexylbenzenecarbothioamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.