(4-methoxyphenyl)methyl N-[3,5-bis(methylsulfanyl)-1,2-thiazol-4-yl]carbamate
TL;DR: (4-methoxyphenyl)methyl N-[3,5-bis(methylsulfanyl)-1,2-thiazol-4-yl]carbamate (CAS 5797-09-1) is a chemical compound with molecular formula C14H16N2O3S3 and molecular weight 356.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4-methoxyphenyl)methyl N-[3,5-bis(methylsulfanyl)-1,2-thiazol-4-yl]carbamate
Also Known As: (4-methoxyphenyl)methyl N-[3,5-bis(methylsulfanyl)-1,2-thiazol-4-yl]carbamate, 4-methoxybenzyl 3,5-bis(methylthio)isothiazol-4-ylcarbamate, A1117/0052442, 4-methoxybenzyl 3,5-bis(methylsulfanyl)-4-isothiazolylcarbamate, 4-methoxybenzyl [3,5-bis(methylsulfanyl)-1,2-thiazol-4-yl]carbamate
| Molecular Formula | C14H16N2O3S3 |
|---|---|
| Molecular Weight | 356.03 g/mol |
| LogP | 4.3442 |
| Topological Polar Surface Area | 60.45 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 356.03232 |
| Heavy Atoms | 22 |
| Complexity | 607.26337 |
Chemical Identifiers
| CAS Number | 5797-09-1 |
|---|---|
| SMILES | COC1=CC=C(C=C1)COC(=O)NC2=C(SN=C2SC)SC |
Product Overview
(4-methoxyphenyl)methyl N-[3,5-bis(methylsulfanyl)-1,2-thiazol-4-yl]carbamate (CAS 5797-09-1), with molecular formula C14H16N2O3S3 and molecular weight 356.03 g/mol. IUPAC: (4-methoxyphenyl)methyl N-[3,5-bis(methylsulfanyl)-1,2-thiazol-4-yl]carbamate.
Chemical Property Profile of (4-methoxyphenyl)methyl N-[3,5-bis(methylsulfanyl)-1,2-thiazol-4-yl]carbamate
Property Insights of (4-methoxyphenyl)methyl N-[3,5-bis(methylsulfanyl)-1,2-thiazol-4-yl]carbamate
The XLogP value of 4.3442 indicates that (4-methoxyphenyl)methyl N-[3,5-bis(methylsulfanyl)-1,2-thiazol-4-yl]carbamate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 60.45 Ų falls within the moderate polarity range, balancing permeability and solubility for (4-methoxyphenyl)methyl N-[3,5-bis(methylsulfanyl)-1,2-thiazol-4-yl]carbamate. Following Lipinski's Rule of Five, (4-methoxyphenyl)methyl N-[3,5-bis(methylsulfanyl)-1,2-thiazol-4-yl]carbamate has 1 hydrogen bond donor(s) and 7 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)methyl N-[3,5-bis(methylsulfanyl)-1,2-thiazol-4-yl]carbamate?
The CAS number of (4-methoxyphenyl)methyl N-[3,5-bis(methylsulfanyl)-1,2-thiazol-4-yl]carbamate is 5797-09-1.
What is the molecular formula of (4-methoxyphenyl)methyl N-[3,5-bis(methylsulfanyl)-1,2-thiazol-4-yl]carbamate?
The molecular formula of (4-methoxyphenyl)methyl N-[3,5-bis(methylsulfanyl)-1,2-thiazol-4-yl]carbamate is C14H16N2O3S3.
What is the molecular weight of (4-methoxyphenyl)methyl N-[3,5-bis(methylsulfanyl)-1,2-thiazol-4-yl]carbamate?
The molecular weight of (4-methoxyphenyl)methyl N-[3,5-bis(methylsulfanyl)-1,2-thiazol-4-yl]carbamate is 356.03 g/mol.
Where can I buy (4-methoxyphenyl)methyl N-[3,5-bis(methylsulfanyl)-1,2-thiazol-4-yl]carbamate?
You can request a quote for (4-methoxyphenyl)methyl N-[3,5-bis(methylsulfanyl)-1,2-thiazol-4-yl]carbamate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (4-methoxyphenyl)methyl N-[3,5-bis(methylsulfanyl)-1,2-thiazol-4-yl]carbamate?
Yes, KEHONG BIO provides custom synthesis services for (4-methoxyphenyl)methyl N-[3,5-bis(methylsulfanyl)-1,2-thiazol-4-yl]carbamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.