![1,2,3-Thiadiazole-4-carboxamide, N-[2-[(1,1-dimethylpropyl)amino]-2-oxoethyl]-N-[2-(trifluoromethyl)phenyl]- (9CI) structure](/static/products/605/605638-06-0.png)
1,2,3-Thiadiazole-4-carboxamide, N-[2-[(1,1-dimethylpropyl)amino]-2-oxoethyl]-N-[2-(trifluoromethyl)phenyl]- (9CI)
TL;DR: 1,2,3-Thiadiazole-4-carboxamide, N-[2-[(1,1-dimethylpropyl)amino]-2-oxoethyl]-N-[2-(trifluoromethyl)phenyl]- (9CI) (CAS 605638-06-0) is a chemical compound with molecular formula C17H19F3N4O2S and molecular weight 400.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[2-(2-methylbutan-2-ylamino)-2-oxoethyl]-N-[2-(trifluoromethyl)phenyl]thiadiazole-4-carboxamide
Also Known As: 1,2,3-Thiadiazole-4-carboxamide, N-[2-[(1,1-dimethylpropyl)amino]-2-oxoethyl]-N-[2-(trifluoromethyl)phenyl]- (9CI), N-(2-methylbutan-2-ylcarbamoylmethyl)-N-[2-(trifluoromethyl)phenyl]thiadiazole-4-carboxamide, N-[2-(2-methylbutan-2-ylamino)-2-oxoethyl]-N-[2-(trifluoromethyl)phenyl]thiadiazole-4-carboxamide
| Molecular Formula | C17H19F3N4O2S |
|---|---|
| Molecular Weight | 400.12 g/mol |
| LogP | 3.5085 |
| Topological Polar Surface Area | 75.19 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 400.11807 |
| Heavy Atoms | 27 |
| Complexity | 806.7599 |
Chemical Identifiers
| CAS Number | 605638-06-0 |
|---|---|
| SMILES | CCC(C)(C)NC(=O)CN(C1=CC=CC=C1C(F)(F)F)C(=O)C2=CSN=N2 |
Product Overview
1,2,3-Thiadiazole-4-carboxamide, N-[2-[(1,1-dimethylpropyl)amino]-2-oxoethyl]-N-[2-(trifluoromethyl)phenyl]- (9CI) (CAS 605638-06-0), with molecular formula C17H19F3N4O2S and molecular weight 400.12 g/mol. IUPAC: N-[2-(2-methylbutan-2-ylamino)-2-oxoethyl]-N-[2-(trifluoromethyl)phenyl]thiadiazole-4-carboxamide.
Chemical Property Profile of 1,2,3-Thiadiazole-4-carboxamide, N-[2-[(1,1-dimethylpropyl)amino]-2-oxoethyl]-N-[2-(trifluoromethyl)phenyl]- (9CI)
Property Insights of 1,2,3-Thiadiazole-4-carboxamide, N-[2-[(1,1-dimethylpropyl)amino]-2-oxoethyl]-N-[2-(trifluoromethyl)phenyl]- (9CI)
The XLogP value of 3.5085 indicates that 1,2,3-Thiadiazole-4-carboxamide, N-[2-[(1,1-dimethylpropyl)amino]-2-oxoethyl]-N-[2-(trifluoromethyl)phenyl]- (9CI) is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 75.19 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,2,3-Thiadiazole-4-carboxamide, N-[2-[(1,1-dimethylpropyl)amino]-2-oxoethyl]-N-[2-(trifluoromethyl)phenyl]- (9CI). Following Lipinski's Rule of Five, 1,2,3-Thiadiazole-4-carboxamide, N-[2-[(1,1-dimethylpropyl)amino]-2-oxoethyl]-N-[2-(trifluoromethyl)phenyl]- (9CI) 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 1,2,3-Thiadiazole-4-carboxamide, N-[2-[(1,1-dimethylpropyl)amino]-2-oxoethyl]-N-[2-(trifluoromethyl)phenyl]- (9CI)?
The CAS number of 1,2,3-Thiadiazole-4-carboxamide, N-[2-[(1,1-dimethylpropyl)amino]-2-oxoethyl]-N-[2-(trifluoromethyl)phenyl]- (9CI) is 605638-06-0.
What is the molecular formula of 1,2,3-Thiadiazole-4-carboxamide, N-[2-[(1,1-dimethylpropyl)amino]-2-oxoethyl]-N-[2-(trifluoromethyl)phenyl]- (9CI)?
The molecular formula of 1,2,3-Thiadiazole-4-carboxamide, N-[2-[(1,1-dimethylpropyl)amino]-2-oxoethyl]-N-[2-(trifluoromethyl)phenyl]- (9CI) is C17H19F3N4O2S.
What is the molecular weight of 1,2,3-Thiadiazole-4-carboxamide, N-[2-[(1,1-dimethylpropyl)amino]-2-oxoethyl]-N-[2-(trifluoromethyl)phenyl]- (9CI)?
The molecular weight of 1,2,3-Thiadiazole-4-carboxamide, N-[2-[(1,1-dimethylpropyl)amino]-2-oxoethyl]-N-[2-(trifluoromethyl)phenyl]- (9CI) is 400.12 g/mol.
Where can I buy 1,2,3-Thiadiazole-4-carboxamide, N-[2-[(1,1-dimethylpropyl)amino]-2-oxoethyl]-N-[2-(trifluoromethyl)phenyl]- (9CI)?
You can request a quote for 1,2,3-Thiadiazole-4-carboxamide, N-[2-[(1,1-dimethylpropyl)amino]-2-oxoethyl]-N-[2-(trifluoromethyl)phenyl]- (9CI) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,2,3-Thiadiazole-4-carboxamide, N-[2-[(1,1-dimethylpropyl)amino]-2-oxoethyl]-N-[2-(trifluoromethyl)phenyl]- (9CI)?
Yes, KEHONG BIO provides custom synthesis services for 1,2,3-Thiadiazole-4-carboxamide, N-[2-[(1,1-dimethylpropyl)amino]-2-oxoethyl]-N-[2-(trifluoromethyl)phenyl]- (9CI) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.