Carbamic acid, ((2,4-dimethylphenyl)thio)methyl-, 2-(1-methylethoxy)phenyl ester
TL;DR: Carbamic acid, ((2,4-dimethylphenyl)thio)methyl-, 2-(1-methylethoxy)phenyl ester (CAS 50539-86-1) is a chemical compound with molecular formula C19H23NO3S and molecular weight 345.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2-propan-2-yloxyphenyl) N-[(2,4-dimethylphenyl)sulfanylmethyl]carbamate
Also Known As: (+)(1S)-1r-Methyl-cyclohexanol-(3t), ((2,4-Xylyl)thio)methylcarbamic acid 2-(1-methylethoxy)phenyl ester, CARBAMIC ACID, ((2,4-DIMETHYLPHENYL)THIO)METHYL-, 2-(1-METHYLETHOXY)PHENYL ESTER, ((2,4-Dimethylphenyl)thio)methylcarbamic acid 2-(1-methylethoxy)phenyl ester, (2-propan-2-yloxyphenyl) N-[(2,4-dimethylphenyl)sulfanylmethyl]carbamate
| Molecular Formula | C19H23NO3S |
|---|---|
| Molecular Weight | 345.14 g/mol |
| LogP | 5.3 |
| Topological Polar Surface Area | 72.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 345.13986 |
| Heavy Atoms | 24 |
| Complexity | 391.0 |
Chemical Identifiers
| CAS Number | 50539-86-1 |
|---|---|
| SMILES | CC1=CC(=C(C=C1)SCNC(=O)OC2=CC=CC=C2OC(C)C)C |
| InChIKey | FJASKIACBNWIMG-UHFFFAOYSA-N |
Product Overview
Carbamic acid, ((2,4-dimethylphenyl)thio)methyl-, 2-(1-methylethoxy)phenyl ester (CAS 50539-86-1), with molecular formula C19H23NO3S and molecular weight 345.14 g/mol. IUPAC: (2-propan-2-yloxyphenyl) N-[(2,4-dimethylphenyl)sulfanylmethyl]carbamate.
Chemical Property Profile of Carbamic acid, ((2,4-dimethylphenyl)thio)methyl-, 2-(1-methylethoxy)phenyl ester
Property Insights of Carbamic acid, ((2,4-dimethylphenyl)thio)methyl-, 2-(1-methylethoxy)phenyl ester
The XLogP value of 5.3 indicates that Carbamic acid, ((2,4-dimethylphenyl)thio)methyl-, 2-(1-methylethoxy)phenyl ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 72.9 Ų falls within the moderate polarity range, balancing permeability and solubility for Carbamic acid, ((2,4-dimethylphenyl)thio)methyl-, 2-(1-methylethoxy)phenyl ester. Following Lipinski's Rule of Five, Carbamic acid, ((2,4-dimethylphenyl)thio)methyl-, 2-(1-methylethoxy)phenyl ester has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Carbamic acid, ((2,4-dimethylphenyl)thio)methyl-, 2-(1-methylethoxy)phenyl ester?
The CAS number of Carbamic acid, ((2,4-dimethylphenyl)thio)methyl-, 2-(1-methylethoxy)phenyl ester is 50539-86-1.
What is the molecular formula of Carbamic acid, ((2,4-dimethylphenyl)thio)methyl-, 2-(1-methylethoxy)phenyl ester?
The molecular formula of Carbamic acid, ((2,4-dimethylphenyl)thio)methyl-, 2-(1-methylethoxy)phenyl ester is C19H23NO3S.
What is the molecular weight of Carbamic acid, ((2,4-dimethylphenyl)thio)methyl-, 2-(1-methylethoxy)phenyl ester?
The molecular weight of Carbamic acid, ((2,4-dimethylphenyl)thio)methyl-, 2-(1-methylethoxy)phenyl ester is 345.14 g/mol.
Where can I buy Carbamic acid, ((2,4-dimethylphenyl)thio)methyl-, 2-(1-methylethoxy)phenyl ester?
You can request a quote for Carbamic acid, ((2,4-dimethylphenyl)thio)methyl-, 2-(1-methylethoxy)phenyl 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, ((2,4-dimethylphenyl)thio)methyl-, 2-(1-methylethoxy)phenyl ester?
Yes, KEHONG BIO provides custom synthesis services for Carbamic acid, ((2,4-dimethylphenyl)thio)methyl-, 2-(1-methylethoxy)phenyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.