Carbamic acid, N-methyl-N-(2-(5-methylthio-3-indolyl)ethyl)-, methyl ester
TL;DR: Carbamic acid, N-methyl-N-(2-(5-methylthio-3-indolyl)ethyl)-, methyl ester (CAS 100836-57-5) is a chemical compound with molecular formula C14H18N2O2S and molecular weight 278.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl N-methyl-N-[2-(5-methylsulfanyl-1H-indol-3-yl)ethyl]carbamate
Also Known As: Methyl N-methyl-N-(5-methylthio-3-indolyl-ethyl-2)carbamate, CARBAMIC ACID, N-METHYL-N-(2-(5-METHYLTHIO-3-INDOLYL)ETHYL)-, METHYL ESTER, methyl methyl{2-[5-(methylsulfanyl)-1h-indol-3-yl]ethyl}carbamate, methyl N-methyl-N-[2-(5-methylsulfanyl-1H-indol-3-yl)ethyl]carbamate, METHYL N-METHYL-N-{2-[5-(METHYLSULFANYL)-1H-INDOL-3-YL]ETHYL}CARBAMATE
| Molecular Formula | C14H18N2O2S |
|---|---|
| Molecular Weight | 278.11 g/mol |
| LogP | 1.9 |
| Topological Polar Surface Area | 70.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 278.1089 |
| Heavy Atoms | 19 |
| Complexity | 314.0 |
Chemical Identifiers
| CAS Number | 100836-57-5 |
|---|---|
| SMILES | CN(CCC1=CNC2=C1C=C(C=C2)SC)C(=O)OC |
| InChIKey | ZUXSQBZSOKPMOX-UHFFFAOYSA-N |
Product Overview
Carbamic acid, N-methyl-N-(2-(5-methylthio-3-indolyl)ethyl)-, methyl ester (CAS 100836-57-5), with molecular formula C14H18N2O2S and molecular weight 278.11 g/mol. IUPAC: methyl N-methyl-N-[2-(5-methylsulfanyl-1H-indol-3-yl)ethyl]carbamate.
Chemical Property Profile of Carbamic acid, N-methyl-N-(2-(5-methylthio-3-indolyl)ethyl)-, methyl ester
Property Insights of Carbamic acid, N-methyl-N-(2-(5-methylthio-3-indolyl)ethyl)-, methyl ester
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Carbamic acid, N-methyl-N-(2-(5-methylthio-3-indolyl)ethyl)-, methyl ester. The TPSA of 70.6 Ų falls within the moderate polarity range, balancing permeability and solubility for Carbamic acid, N-methyl-N-(2-(5-methylthio-3-indolyl)ethyl)-, methyl ester. Following Lipinski's Rule of Five, Carbamic acid, N-methyl-N-(2-(5-methylthio-3-indolyl)ethyl)-, methyl ester has 1 hydrogen bond donor(s) and 3 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-methyl-N-(2-(5-methylthio-3-indolyl)ethyl)-, methyl ester?
The CAS number of Carbamic acid, N-methyl-N-(2-(5-methylthio-3-indolyl)ethyl)-, methyl ester is 100836-57-5.
What is the molecular formula of Carbamic acid, N-methyl-N-(2-(5-methylthio-3-indolyl)ethyl)-, methyl ester?
The molecular formula of Carbamic acid, N-methyl-N-(2-(5-methylthio-3-indolyl)ethyl)-, methyl ester is C14H18N2O2S.
What is the molecular weight of Carbamic acid, N-methyl-N-(2-(5-methylthio-3-indolyl)ethyl)-, methyl ester?
The molecular weight of Carbamic acid, N-methyl-N-(2-(5-methylthio-3-indolyl)ethyl)-, methyl ester is 278.11 g/mol.
Where can I buy Carbamic acid, N-methyl-N-(2-(5-methylthio-3-indolyl)ethyl)-, methyl ester?
You can request a quote for Carbamic acid, N-methyl-N-(2-(5-methylthio-3-indolyl)ethyl)-, methyl 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-methyl-N-(2-(5-methylthio-3-indolyl)ethyl)-, methyl ester?
Yes, KEHONG BIO provides custom synthesis services for Carbamic acid, N-methyl-N-(2-(5-methylthio-3-indolyl)ethyl)-, methyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.