Isopropyl 2,2,2-trichloro-1-(mesitylamino)ethylcarbamate
TL;DR: Isopropyl 2,2,2-trichloro-1-(mesitylamino)ethylcarbamate (CAS 321679-90-7) is a chemical compound with molecular formula C15H21Cl3N2O2 and molecular weight 366.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
propan-2-yl N-[2,2,2-trichloro-1-(2,4,6-trimethylanilino)ethyl]carbamate
Also Known As: isopropyl 2,2,2-trichloro-1-(mesitylamino)ethylcarbamate, BAS 00392199, propan-2-yl N-[2,2,2-trichloro-1-(2,4,6-trimethylanilino)ethyl]carbamate, [2,2,2-Trichloro-1-(2,4,6-trimethyl-phenylamino)-ethyl]-carbamic acid isopropyl, PROPAN-2-YL N-{2,2,2-TRICHLORO-1-[(2,4,6-TRIMETHYLPHENYL)AMINO]ETHYL}CARBAMATE
| Molecular Formula | C15H21Cl3N2O2 |
|---|---|
| Molecular Weight | 366.07 g/mol |
| LogP | 4.85466 |
| Topological Polar Surface Area | 50.36 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 366.06686 |
| Heavy Atoms | 22 |
| Complexity | 519.07446 |
Chemical Identifiers
| CAS Number | 321679-90-7 |
|---|---|
| SMILES | CC1=CC(=C(C(=C1)C)NC(C(Cl)(Cl)Cl)NC(=O)OC(C)C)C |
Product Overview
Isopropyl 2,2,2-trichloro-1-(mesitylamino)ethylcarbamate (CAS 321679-90-7), with molecular formula C15H21Cl3N2O2 and molecular weight 366.07 g/mol. IUPAC: propan-2-yl N-[2,2,2-trichloro-1-(2,4,6-trimethylanilino)ethyl]carbamate.
Chemical Property Profile of Isopropyl 2,2,2-trichloro-1-(mesitylamino)ethylcarbamate
Property Insights of Isopropyl 2,2,2-trichloro-1-(mesitylamino)ethylcarbamate
The XLogP value of 4.85466 indicates that Isopropyl 2,2,2-trichloro-1-(mesitylamino)ethylcarbamate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 50.36 Ų, Isopropyl 2,2,2-trichloro-1-(mesitylamino)ethylcarbamate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Isopropyl 2,2,2-trichloro-1-(mesitylamino)ethylcarbamate has 2 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 Isopropyl 2,2,2-trichloro-1-(mesitylamino)ethylcarbamate?
The CAS number of Isopropyl 2,2,2-trichloro-1-(mesitylamino)ethylcarbamate is 321679-90-7.
What is the molecular formula of Isopropyl 2,2,2-trichloro-1-(mesitylamino)ethylcarbamate?
The molecular formula of Isopropyl 2,2,2-trichloro-1-(mesitylamino)ethylcarbamate is C15H21Cl3N2O2.
What is the molecular weight of Isopropyl 2,2,2-trichloro-1-(mesitylamino)ethylcarbamate?
The molecular weight of Isopropyl 2,2,2-trichloro-1-(mesitylamino)ethylcarbamate is 366.07 g/mol.
Where can I buy Isopropyl 2,2,2-trichloro-1-(mesitylamino)ethylcarbamate?
You can request a quote for Isopropyl 2,2,2-trichloro-1-(mesitylamino)ethylcarbamate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Isopropyl 2,2,2-trichloro-1-(mesitylamino)ethylcarbamate?
Yes, KEHONG BIO provides custom synthesis services for Isopropyl 2,2,2-trichloro-1-(mesitylamino)ethylcarbamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.