![ethyl N-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]carbamate structure](/static/products/5327/5327-04-8.webp)
ethyl N-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]carbamate
TL;DR: ethyl N-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]carbamate (CAS 5327-04-8) is a chemical compound with molecular formula C9H15N3O2S and molecular weight 229.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl N-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]carbamate
Also Known As: DivK1c_005024, CDS1_003984, BAS 00321642, BIM-0017433.P001, ethyl (5-isobutyl-1,3,4-thiadiazol-2-yl)carbamate
| Molecular Formula | C9H15N3O2S |
|---|---|
| Molecular Weight | 229.09 g/mol |
| LogP | 2.3 |
| Topological Polar Surface Area | 92.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 229.0885 |
| Heavy Atoms | 15 |
| Complexity | 214.0 |
Chemical Identifiers
| CAS Number | 5327-04-8 |
|---|---|
| SMILES | CCOC(=O)NC1=NN=C(S1)CC(C)C |
| InChIKey | YKSKHCCCACRHDP-UHFFFAOYSA-N |
Product Overview
ethyl N-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]carbamate (CAS 5327-04-8), with molecular formula C9H15N3O2S and molecular weight 229.09 g/mol. IUPAC: ethyl N-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]carbamate.
Chemical Property Profile of ethyl N-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]carbamate
Property Insights of ethyl N-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]carbamate
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for ethyl N-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]carbamate. The TPSA of 92.4 Ų falls within the moderate polarity range, balancing permeability and solubility for ethyl N-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]carbamate. Following Lipinski's Rule of Five, ethyl N-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]carbamate has 1 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 ethyl N-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]carbamate?
The CAS number of ethyl N-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]carbamate is 5327-04-8.
What is the molecular formula of ethyl N-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]carbamate?
The molecular formula of ethyl N-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]carbamate is C9H15N3O2S.
What is the molecular weight of ethyl N-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]carbamate?
The molecular weight of ethyl N-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]carbamate is 229.09 g/mol.
Where can I buy ethyl N-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]carbamate?
You can request a quote for ethyl N-[5-(2-methylpropyl)-1,3,4-thiadiazol-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 ethyl N-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]carbamate?
Yes, KEHONG BIO provides custom synthesis services for ethyl N-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]carbamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.