Methyl 3-(aminocarbonyl)-4-ethyl-5-methyl-2-thienylcarbamate
TL;DR: Methyl 3-(aminocarbonyl)-4-ethyl-5-methyl-2-thienylcarbamate (CAS 543684-44-2) is a chemical compound with molecular formula C10H14N2O3S and molecular weight 242.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl N-(3-carbamoyl-4-ethyl-5-methylthiophen-2-yl)carbamate
Also Known As: methyl 3-(aminocarbonyl)-4-ethyl-5-methyl-2-thienylcarbamate, methyl (3-carbamoyl-4-ethyl-5-methylthiophen-2-yl)carbamate, methyl N-(3-carbamoyl-4-ethyl-5-methylthiophen-2-yl)carbamate, 4-ethyl-2-(methoxycarbonylamino)-5-methylthiophene-3-carboxamide, methyl [3-(aminocarbonyl)-4-ethyl-5-methyl-2-thienyl]carbamate
| Molecular Formula | C10H14N2O3S |
|---|---|
| Molecular Weight | 242.07 g/mol |
| LogP | 1.89612 |
| Topological Polar Surface Area | 81.42 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 242.07251 |
| Heavy Atoms | 16 |
| Complexity | 425.9438 |
Chemical Identifiers
| CAS Number | 543684-44-2 |
|---|---|
| SMILES | CCC1=C(SC(=C1C(=O)N)NC(=O)OC)C |
Product Overview
Methyl 3-(aminocarbonyl)-4-ethyl-5-methyl-2-thienylcarbamate (CAS 543684-44-2), with molecular formula C10H14N2O3S and molecular weight 242.07 g/mol. IUPAC: methyl N-(3-carbamoyl-4-ethyl-5-methylthiophen-2-yl)carbamate.
Chemical Property Profile of Methyl 3-(aminocarbonyl)-4-ethyl-5-methyl-2-thienylcarbamate
Property Insights of Methyl 3-(aminocarbonyl)-4-ethyl-5-methyl-2-thienylcarbamate
The XLogP value of 1.89612 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl 3-(aminocarbonyl)-4-ethyl-5-methyl-2-thienylcarbamate. The TPSA of 81.42 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl 3-(aminocarbonyl)-4-ethyl-5-methyl-2-thienylcarbamate. Following Lipinski's Rule of Five, Methyl 3-(aminocarbonyl)-4-ethyl-5-methyl-2-thienylcarbamate has 2 hydrogen bond donor(s) and 4 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 Methyl 3-(aminocarbonyl)-4-ethyl-5-methyl-2-thienylcarbamate?
The CAS number of Methyl 3-(aminocarbonyl)-4-ethyl-5-methyl-2-thienylcarbamate is 543684-44-2.
What is the molecular formula of Methyl 3-(aminocarbonyl)-4-ethyl-5-methyl-2-thienylcarbamate?
The molecular formula of Methyl 3-(aminocarbonyl)-4-ethyl-5-methyl-2-thienylcarbamate is C10H14N2O3S.
What is the molecular weight of Methyl 3-(aminocarbonyl)-4-ethyl-5-methyl-2-thienylcarbamate?
The molecular weight of Methyl 3-(aminocarbonyl)-4-ethyl-5-methyl-2-thienylcarbamate is 242.07 g/mol.
Where can I buy Methyl 3-(aminocarbonyl)-4-ethyl-5-methyl-2-thienylcarbamate?
You can request a quote for Methyl 3-(aminocarbonyl)-4-ethyl-5-methyl-2-thienylcarbamate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 3-(aminocarbonyl)-4-ethyl-5-methyl-2-thienylcarbamate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 3-(aminocarbonyl)-4-ethyl-5-methyl-2-thienylcarbamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.