Carbamic acid, N-((diethylamino)thio)-N-methyl-, o-isopropoxyphenyl ester
TL;DR: Carbamic acid, N-((diethylamino)thio)-N-methyl-, o-isopropoxyphenyl ester (CAS 64730-98-9) is a chemical compound with molecular formula C15H24N2O3S and molecular weight 312.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2-propan-2-yloxyphenyl) N-(diethylaminosulfanyl)-N-methylcarbamate
Also Known As: N-(Diethylamino)thio-N-methylcarbamic acid o-isopropoxyphenyl ester, 2-Isopropoxyphenyl N-diethylaminosulfenyl-N-methylcarbamate, Carbamic acid, N-((diethylamino)thio)-N-methyl-, o-isopropoxyphenyl ester, (2-propan-2-yloxyphenyl) N-(diethylaminosulfanyl)-N-methylcarbamate, 2-(propan-2-yloxy)phenyl N-[(diethylamino)sulfanyl]-N-methylcarbamate
| Molecular Formula | C15H24N2O3S |
|---|---|
| Molecular Weight | 312.15 g/mol |
| LogP | 3.5 |
| Topological Polar Surface Area | 67.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 8 |
| Exact Mass | 312.15076 |
| Heavy Atoms | 21 |
| Complexity | 311.0 |
Chemical Identifiers
| CAS Number | 64730-98-9 |
|---|---|
| SMILES | CCN(CC)SN(C)C(=O)OC1=CC=CC=C1OC(C)C |
| InChIKey | RTSJPYIBJKXKIE-UHFFFAOYSA-N |
Product Overview
Carbamic acid, N-((diethylamino)thio)-N-methyl-, o-isopropoxyphenyl ester (CAS 64730-98-9), with molecular formula C15H24N2O3S and molecular weight 312.15 g/mol. IUPAC: (2-propan-2-yloxyphenyl) N-(diethylaminosulfanyl)-N-methylcarbamate.
Chemical Property Profile of Carbamic acid, N-((diethylamino)thio)-N-methyl-, o-isopropoxyphenyl ester
Property Insights of Carbamic acid, N-((diethylamino)thio)-N-methyl-, o-isopropoxyphenyl ester
The XLogP value of 3.5 indicates that Carbamic acid, N-((diethylamino)thio)-N-methyl-, o-isopropoxyphenyl ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 67.3 Ų falls within the moderate polarity range, balancing permeability and solubility for Carbamic acid, N-((diethylamino)thio)-N-methyl-, o-isopropoxyphenyl ester. Following Lipinski's Rule of Five, Carbamic acid, N-((diethylamino)thio)-N-methyl-, o-isopropoxyphenyl ester has 0 hydrogen bond donor(s) and 5 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 Carbamic acid, N-((diethylamino)thio)-N-methyl-, o-isopropoxyphenyl ester?
The CAS number of Carbamic acid, N-((diethylamino)thio)-N-methyl-, o-isopropoxyphenyl ester is 64730-98-9.
What is the molecular formula of Carbamic acid, N-((diethylamino)thio)-N-methyl-, o-isopropoxyphenyl ester?
The molecular formula of Carbamic acid, N-((diethylamino)thio)-N-methyl-, o-isopropoxyphenyl ester is C15H24N2O3S.
What is the molecular weight of Carbamic acid, N-((diethylamino)thio)-N-methyl-, o-isopropoxyphenyl ester?
The molecular weight of Carbamic acid, N-((diethylamino)thio)-N-methyl-, o-isopropoxyphenyl ester is 312.15 g/mol.
Where can I buy Carbamic acid, N-((diethylamino)thio)-N-methyl-, o-isopropoxyphenyl ester?
You can request a quote for Carbamic acid, N-((diethylamino)thio)-N-methyl-, o-isopropoxyphenyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Carbamic acid, N-((diethylamino)thio)-N-methyl-, o-isopropoxyphenyl ester?
Yes, KEHONG BIO provides custom synthesis services for Carbamic acid, N-((diethylamino)thio)-N-methyl-, o-isopropoxyphenyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.