(1-acetamido-2,2,2-trichloroethyl) N,N-bis(2-methylpropyl)carbamodithioate
TL;DR: (1-acetamido-2,2,2-trichloroethyl) N,N-bis(2-methylpropyl)carbamodithioate (CAS 372156-03-1) is a chemical compound with molecular formula C13H23Cl3N2OS2 and molecular weight 392.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(1-acetamido-2,2,2-trichloroethyl) N,N-bis(2-methylpropyl)carbamodithioate
Also Known As: 1-acetamido-2,2,2-trichloroethyl diisobutylcarbamodithioate, (1-acetamido-2,2,2-trichloroethyl) N,N-bis(2-methylpropyl)carbamodithioate, Diisobutyl-dithiocarbamic acid 1-acetylamino-2,2,2-trichloro-ethyl ester, 1-(acetylamino)-2,2,2-trichloroethyl bis(2-methylpropyl)carbamodithioate, [1-acetamido-2,2,2-tris(chloranyl)ethyl] N,N-bis(2-methylpropyl)carbamodithioate
| Molecular Formula | C13H23Cl3N2OS2 |
|---|---|
| Molecular Weight | 392.03 g/mol |
| LogP | 4.4509 |
| Topological Polar Surface Area | 32.34 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 392.03174 |
| Heavy Atoms | 21 |
| Complexity | 349.81577 |
Chemical Identifiers
| CAS Number | 372156-03-1 |
|---|---|
| SMILES | CC(C)CN(CC(C)C)C(=S)SC(C(Cl)(Cl)Cl)NC(=O)C |
Product Overview
(1-acetamido-2,2,2-trichloroethyl) N,N-bis(2-methylpropyl)carbamodithioate (CAS 372156-03-1), with molecular formula C13H23Cl3N2OS2 and molecular weight 392.03 g/mol. IUPAC: (1-acetamido-2,2,2-trichloroethyl) N,N-bis(2-methylpropyl)carbamodithioate.
Chemical Property Profile of (1-acetamido-2,2,2-trichloroethyl) N,N-bis(2-methylpropyl)carbamodithioate
Property Insights of (1-acetamido-2,2,2-trichloroethyl) N,N-bis(2-methylpropyl)carbamodithioate
The XLogP value of 4.4509 indicates that (1-acetamido-2,2,2-trichloroethyl) N,N-bis(2-methylpropyl)carbamodithioate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 32.34 Ų, (1-acetamido-2,2,2-trichloroethyl) N,N-bis(2-methylpropyl)carbamodithioate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (1-acetamido-2,2,2-trichloroethyl) N,N-bis(2-methylpropyl)carbamodithioate has 1 hydrogen bond donor(s) and 3 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 (1-acetamido-2,2,2-trichloroethyl) N,N-bis(2-methylpropyl)carbamodithioate?
The CAS number of (1-acetamido-2,2,2-trichloroethyl) N,N-bis(2-methylpropyl)carbamodithioate is 372156-03-1.
What is the molecular formula of (1-acetamido-2,2,2-trichloroethyl) N,N-bis(2-methylpropyl)carbamodithioate?
The molecular formula of (1-acetamido-2,2,2-trichloroethyl) N,N-bis(2-methylpropyl)carbamodithioate is C13H23Cl3N2OS2.
What is the molecular weight of (1-acetamido-2,2,2-trichloroethyl) N,N-bis(2-methylpropyl)carbamodithioate?
The molecular weight of (1-acetamido-2,2,2-trichloroethyl) N,N-bis(2-methylpropyl)carbamodithioate is 392.03 g/mol.
Where can I buy (1-acetamido-2,2,2-trichloroethyl) N,N-bis(2-methylpropyl)carbamodithioate?
You can request a quote for (1-acetamido-2,2,2-trichloroethyl) N,N-bis(2-methylpropyl)carbamodithioate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (1-acetamido-2,2,2-trichloroethyl) N,N-bis(2-methylpropyl)carbamodithioate?
Yes, KEHONG BIO provides custom synthesis services for (1-acetamido-2,2,2-trichloroethyl) N,N-bis(2-methylpropyl)carbamodithioate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.