Carbamothioic acid, N-ethyl-N-(2-phenylprop-2-yl)-, S-ethyl ester
TL;DR: Carbamothioic acid, N-ethyl-N-(2-phenylprop-2-yl)-, S-ethyl ester (CAS 130756-22-8) is a chemical compound with molecular formula C14H21NOS and molecular weight 251.13438 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
S-ethyl N-ethyl-N-(2-phenylpropan-2-yl)carbamothioate
Also Known As: s-ethyl ethyl(2-phenylpropan-2-yl)carbamothioate, S-ethyl N-ethyl-N-(2-phenylpropan-2-yl)carbamothioate, Carbamothioic acid, N-ethyl-N-(2-phenylprop-2-yl)-, S-ethyl ester, N-ethyl-1-ethylsulfanyl-N-(2-phenylpropan-2-yl)formamide
Technical Specifications
| Molecular Formula | C14H21NOS |
| Molecular Weight | 251.13438 g/mol |
| XLogP | 3.5 |
| Topological Polar Surface Area (TPSA) | 45.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 251.13438 Da |
| Heavy Atoms | 17 |
| Complexity | 247.0 |
| SMILES | CCN(C(=O)SCC)C(C)(C)C1=CC=CC=C1 |
| InChIKey | KTTLWQKGTNPVEI-UHFFFAOYSA-N |
Chemical Property Profile of Carbamothioic acid, N-ethyl-N-(2-phenylprop-2-yl)-, S-ethyl ester
Property Insights of Carbamothioic acid, N-ethyl-N-(2-phenylprop-2-yl)-, S-ethyl ester
The XLogP value of 3.5 indicates that Carbamothioic acid, N-ethyl-N-(2-phenylprop-2-yl)-, S-ethyl ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 45.6 Ų, Carbamothioic acid, N-ethyl-N-(2-phenylprop-2-yl)-, S-ethyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Carbamothioic acid, N-ethyl-N-(2-phenylprop-2-yl)-, S-ethyl ester has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Carbamothioic acid, N-ethyl-N-(2-phenylprop-2-yl)-, S-ethyl ester?
The CAS number of Carbamothioic acid, N-ethyl-N-(2-phenylprop-2-yl)-, S-ethyl ester is 130756-22-8.
What is the molecular formula of Carbamothioic acid, N-ethyl-N-(2-phenylprop-2-yl)-, S-ethyl ester?
The molecular formula of Carbamothioic acid, N-ethyl-N-(2-phenylprop-2-yl)-, S-ethyl ester is C14H21NOS.
What is the molecular weight of Carbamothioic acid, N-ethyl-N-(2-phenylprop-2-yl)-, S-ethyl ester?
The molecular weight of Carbamothioic acid, N-ethyl-N-(2-phenylprop-2-yl)-, S-ethyl ester is 251.13438 g/mol.
Where can I buy Carbamothioic acid, N-ethyl-N-(2-phenylprop-2-yl)-, S-ethyl ester?
You can request a quote for Carbamothioic acid, N-ethyl-N-(2-phenylprop-2-yl)-, S-ethyl ester directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Carbamothioic acid, N-ethyl-N-(2-phenylprop-2-yl)-, S-ethyl ester?
Yes, CoreyChem provides custom synthesis services for Carbamothioic acid, N-ethyl-N-(2-phenylprop-2-yl)-, S-ethyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.