Butanethioamide, N-(2-chlorophenyl)-3,3-dimethyl-
TL;DR: Butanethioamide, N-(2-chlorophenyl)-3,3-dimethyl- (CAS 62635-54-5) is a chemical compound with molecular formula C12H16ClNS and molecular weight 241.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(2-chlorophenyl)-3,3-dimethylbutanethioamide
Also Known As: N-(2-chlorophenyl)-3,3-dimethylbutanethioamide, Butanethioamide, N-(2-chlorophenyl)-3,3-dimethyl-, Butanethioamide,N-(2-chlorophenyl)-3,3-dimethyl-
| Molecular Formula | C12H16ClNS |
|---|---|
| Molecular Weight | 241.07 g/mol |
| LogP | 4.5155 |
| Topological Polar Surface Area | 12.03 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 241.0692 |
| Heavy Atoms | 15 |
| Complexity | 354.88492 |
Chemical Identifiers
| CAS Number | 62635-54-5 |
|---|---|
| SMILES | CC(C)(C)CC(=S)NC1=CC=CC=C1Cl |
Product Overview
Butanethioamide, N-(2-chlorophenyl)-3,3-dimethyl- (CAS 62635-54-5), with molecular formula C12H16ClNS and molecular weight 241.07 g/mol. IUPAC: N-(2-chlorophenyl)-3,3-dimethylbutanethioamide.
Chemical Property Profile of Butanethioamide, N-(2-chlorophenyl)-3,3-dimethyl-
Property Insights of Butanethioamide, N-(2-chlorophenyl)-3,3-dimethyl-
The XLogP value of 4.5155 indicates that Butanethioamide, N-(2-chlorophenyl)-3,3-dimethyl- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 12.03 Ų, Butanethioamide, N-(2-chlorophenyl)-3,3-dimethyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Butanethioamide, N-(2-chlorophenyl)-3,3-dimethyl- 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 Butanethioamide, N-(2-chlorophenyl)-3,3-dimethyl-?
The CAS number of Butanethioamide, N-(2-chlorophenyl)-3,3-dimethyl- is 62635-54-5.
What is the molecular formula of Butanethioamide, N-(2-chlorophenyl)-3,3-dimethyl-?
The molecular formula of Butanethioamide, N-(2-chlorophenyl)-3,3-dimethyl- is C12H16ClNS.
What is the molecular weight of Butanethioamide, N-(2-chlorophenyl)-3,3-dimethyl-?
The molecular weight of Butanethioamide, N-(2-chlorophenyl)-3,3-dimethyl- is 241.07 g/mol.
Where can I buy Butanethioamide, N-(2-chlorophenyl)-3,3-dimethyl-?
You can request a quote for Butanethioamide, N-(2-chlorophenyl)-3,3-dimethyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Butanethioamide, N-(2-chlorophenyl)-3,3-dimethyl-?
Yes, KEHONG BIO provides custom synthesis services for Butanethioamide, N-(2-chlorophenyl)-3,3-dimethyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.