(4-Methoxyphenyl)methylcarbamothioyl chloride
TL;DR: (4-Methoxyphenyl)methylcarbamothioyl chloride (CAS 55246-79-2) is a chemical compound with molecular formula C9H10ClNOS and molecular weight 215.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(4-methoxyphenyl)-N-methylcarbamothioyl chloride
Also Known As: N-(4-Methoxyphenyl)-N-methylthiocarbamoyl chloride, N-(4-methoxyphenyl)-N-methylcarbamothioyl chloride, Methyl-p-tolyl-thiocarbamoylchlorid, (4-Methoxyphenyl)methylcarbamothioyl chloride, N- -N-METHYLTHIOCARBAMOYLCHLORIDE
| Molecular Formula | C9H10ClNOS |
|---|---|
| Molecular Weight | 215.02 g/mol |
| LogP | 2.6551 |
| Topological Polar Surface Area | 12.47 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 215.01717 |
| Heavy Atoms | 13 |
| Complexity | 298.98795 |
Chemical Identifiers
| CAS Number | 55246-79-2 |
|---|---|
| SMILES | CN(C1=CC=C(C=C1)OC)C(=S)Cl |
Product Overview
(4-Methoxyphenyl)methylcarbamothioyl chloride (CAS 55246-79-2), with molecular formula C9H10ClNOS and molecular weight 215.02 g/mol. IUPAC: N-(4-methoxyphenyl)-N-methylcarbamothioyl chloride.
Chemical Property Profile of (4-Methoxyphenyl)methylcarbamothioyl chloride
Property Insights of (4-Methoxyphenyl)methylcarbamothioyl chloride
The XLogP value of 2.6551 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (4-Methoxyphenyl)methylcarbamothioyl chloride. With a topological polar surface area (TPSA) of 12.47 Ų, (4-Methoxyphenyl)methylcarbamothioyl chloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (4-Methoxyphenyl)methylcarbamothioyl chloride has 0 hydrogen bond donor(s) and 2 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 (4-Methoxyphenyl)methylcarbamothioyl chloride?
The CAS number of (4-Methoxyphenyl)methylcarbamothioyl chloride is 55246-79-2.
What is the molecular formula of (4-Methoxyphenyl)methylcarbamothioyl chloride?
The molecular formula of (4-Methoxyphenyl)methylcarbamothioyl chloride is C9H10ClNOS.
What is the molecular weight of (4-Methoxyphenyl)methylcarbamothioyl chloride?
The molecular weight of (4-Methoxyphenyl)methylcarbamothioyl chloride is 215.02 g/mol.
Where can I buy (4-Methoxyphenyl)methylcarbamothioyl chloride?
You can request a quote for (4-Methoxyphenyl)methylcarbamothioyl chloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (4-Methoxyphenyl)methylcarbamothioyl chloride?
Yes, KEHONG BIO provides custom synthesis services for (4-Methoxyphenyl)methylcarbamothioyl chloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.