methyl N-[3-carbamoyl-5-(diethylcarbamoyl)-4-methylthiophen-2-yl]carbamate
TL;DR: methyl N-[3-carbamoyl-5-(diethylcarbamoyl)-4-methylthiophen-2-yl]carbamate (CAS 676249-25-5) is a chemical compound with molecular formula C13H19N3O4S and molecular weight 313.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl N-[3-carbamoyl-5-(diethylcarbamoyl)-4-methylthiophen-2-yl]carbamate
Also Known As: methyl N-[3-carbamoyl-5-(diethylcarbamoyl)-4-methylthiophen-2-yl]carbamate, BRD-K30912208-001-01-3, N-[3-carbamoyl-5-[diethylamino(oxo)methyl]-4-methyl-2-thiophenyl]carbamic acid methyl ester, methyl [3-carbamoyl-5-(diethylcarbamoyl)-4-methylthiophen-2-yl]carbamate, 5-(N,N-diethylcarbamoyl)-2-(methoxycarbonylamino)-4-methylthiophene-3-carboxam ide
| Molecular Formula | C13H19N3O4S |
|---|---|
| Molecular Weight | 313.11 g/mol |
| LogP | 1.8 |
| Topological Polar Surface Area | 130.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 313.10962 |
| Heavy Atoms | 21 |
| Complexity | 414.0 |
Chemical Identifiers
| CAS Number | 676249-25-5 |
|---|---|
| SMILES | CCN(CC)C(=O)C1=C(C(=C(S1)NC(=O)OC)C(=O)N)C |
| InChIKey | DVNGBIXMIGNILE-UHFFFAOYSA-N |
Product Overview
methyl N-[3-carbamoyl-5-(diethylcarbamoyl)-4-methylthiophen-2-yl]carbamate (CAS 676249-25-5), with molecular formula C13H19N3O4S and molecular weight 313.11 g/mol. IUPAC: methyl N-[3-carbamoyl-5-(diethylcarbamoyl)-4-methylthiophen-2-yl]carbamate.
Chemical Property Profile of methyl N-[3-carbamoyl-5-(diethylcarbamoyl)-4-methylthiophen-2-yl]carbamate
Property Insights of methyl N-[3-carbamoyl-5-(diethylcarbamoyl)-4-methylthiophen-2-yl]carbamate
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for methyl N-[3-carbamoyl-5-(diethylcarbamoyl)-4-methylthiophen-2-yl]carbamate. The TPSA of 130.0 Ų falls within the moderate polarity range, balancing permeability and solubility for methyl N-[3-carbamoyl-5-(diethylcarbamoyl)-4-methylthiophen-2-yl]carbamate. Following Lipinski's Rule of Five, methyl N-[3-carbamoyl-5-(diethylcarbamoyl)-4-methylthiophen-2-yl]carbamate 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 methyl N-[3-carbamoyl-5-(diethylcarbamoyl)-4-methylthiophen-2-yl]carbamate?
The CAS number of methyl N-[3-carbamoyl-5-(diethylcarbamoyl)-4-methylthiophen-2-yl]carbamate is 676249-25-5.
What is the molecular formula of methyl N-[3-carbamoyl-5-(diethylcarbamoyl)-4-methylthiophen-2-yl]carbamate?
The molecular formula of methyl N-[3-carbamoyl-5-(diethylcarbamoyl)-4-methylthiophen-2-yl]carbamate is C13H19N3O4S.
What is the molecular weight of methyl N-[3-carbamoyl-5-(diethylcarbamoyl)-4-methylthiophen-2-yl]carbamate?
The molecular weight of methyl N-[3-carbamoyl-5-(diethylcarbamoyl)-4-methylthiophen-2-yl]carbamate is 313.11 g/mol.
Where can I buy methyl N-[3-carbamoyl-5-(diethylcarbamoyl)-4-methylthiophen-2-yl]carbamate?
You can request a quote for methyl N-[3-carbamoyl-5-(diethylcarbamoyl)-4-methylthiophen-2-yl]carbamate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for methyl N-[3-carbamoyl-5-(diethylcarbamoyl)-4-methylthiophen-2-yl]carbamate?
Yes, KEHONG BIO provides custom synthesis services for methyl N-[3-carbamoyl-5-(diethylcarbamoyl)-4-methylthiophen-2-yl]carbamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.