S-(4-Hydroxyphenyl) N-(2,5-dimethoxyphenyl)thiocarbamate
TL;DR: S-(4-Hydroxyphenyl) N-(2,5-dimethoxyphenyl)thiocarbamate (CAS 63746-97-4) is a chemical compound with molecular formula C15H15NO4S and molecular weight 305.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
S-(4-hydroxyphenyl) N-(2,5-dimethoxyphenyl)carbamothioate
Also Known As: S-(4-HYDROXYPHENYL) N-(2,5-DIMETHOXYPHENYL)THIOCARBAMATE, S-(4-hydroxyphenyl) N-(2,5-dimethoxyphenyl)carbamothioate, N-(2,5-dimethoxyphenyl)-1-(4-hydroxyphenyl)sulfanyl-formamide, 666-052-7, RefChem:884150
| Molecular Formula | C15H15NO4S |
|---|---|
| Molecular Weight | 305.07 g/mol |
| LogP | 3.7336 |
| Topological Polar Surface Area | 67.79 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 305.07217 |
| Heavy Atoms | 21 |
| Complexity | 628.0708 |
Chemical Identifiers
| CAS Number | 63746-97-4 |
|---|---|
| SMILES | COC1=CC(=C(C=C1)OC)NC(=O)SC2=CC=C(C=C2)O |
Product Overview
S-(4-Hydroxyphenyl) N-(2,5-dimethoxyphenyl)thiocarbamate (CAS 63746-97-4), with molecular formula C15H15NO4S and molecular weight 305.07 g/mol. IUPAC: S-(4-hydroxyphenyl) N-(2,5-dimethoxyphenyl)carbamothioate.
Chemical Property Profile of S-(4-Hydroxyphenyl) N-(2,5-dimethoxyphenyl)thiocarbamate
Property Insights of S-(4-Hydroxyphenyl) N-(2,5-dimethoxyphenyl)thiocarbamate
The XLogP value of 3.7336 indicates that S-(4-Hydroxyphenyl) N-(2,5-dimethoxyphenyl)thiocarbamate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 67.79 Ų falls within the moderate polarity range, balancing permeability and solubility for S-(4-Hydroxyphenyl) N-(2,5-dimethoxyphenyl)thiocarbamate. Following Lipinski's Rule of Five, S-(4-Hydroxyphenyl) N-(2,5-dimethoxyphenyl)thiocarbamate has 2 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 S-(4-Hydroxyphenyl) N-(2,5-dimethoxyphenyl)thiocarbamate?
The CAS number of S-(4-Hydroxyphenyl) N-(2,5-dimethoxyphenyl)thiocarbamate is 63746-97-4.
What is the molecular formula of S-(4-Hydroxyphenyl) N-(2,5-dimethoxyphenyl)thiocarbamate?
The molecular formula of S-(4-Hydroxyphenyl) N-(2,5-dimethoxyphenyl)thiocarbamate is C15H15NO4S.
What is the molecular weight of S-(4-Hydroxyphenyl) N-(2,5-dimethoxyphenyl)thiocarbamate?
The molecular weight of S-(4-Hydroxyphenyl) N-(2,5-dimethoxyphenyl)thiocarbamate is 305.07 g/mol.
Where can I buy S-(4-Hydroxyphenyl) N-(2,5-dimethoxyphenyl)thiocarbamate?
You can request a quote for S-(4-Hydroxyphenyl) N-(2,5-dimethoxyphenyl)thiocarbamate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for S-(4-Hydroxyphenyl) N-(2,5-dimethoxyphenyl)thiocarbamate?
Yes, KEHONG BIO provides custom synthesis services for S-(4-Hydroxyphenyl) N-(2,5-dimethoxyphenyl)thiocarbamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.