CBMicro_021269
3-chloro-5-thiophen-2-yl-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-2-carboxylic acid
Also Known As: CBMicro_021269|BAS 01841086|BIM-0021345.P001|SR-01000436745-1|3-chloro-5-(thiophen-2-yl)-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-2-carboxylic acid|3-chloro-5-(2-thienyl)-7-(trifluoromethyl)-4H,5H,6H,7H-pyrazolo[1,5-a]1,3-diaz aperhydroine-2-carboxylic acid|3-chloro-5-thiophen-2-yl-7-(trifluoromethyl)-1,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-2-carboxylic acid
| Molecular Formula | C12H9ClF3N3O2S |
|---|---|
| Molecular Weight | 351.0056 g/mol |
| LogP | 3.9565 |
| Topological Polar Surface Area | 67.15 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 351.0056 |
| Monoisotopic Mass | 351.0056 |
| Heavy Atoms | 22 |
| Complexity | 714.0152 |
Chemical Identifiers
| CAS Number | 332852-72-9 |
|---|---|
| SMILES | C1C(NC2=C(C(=NN2C1C(F)(F)F)C(=O)O)Cl)C3=CC=CS3 |
Product Overview
CBMicro_021269 (CAS 332852-72-9), with molecular formula C12H9ClF3N3O2S and molecular weight 351.0056 g/mol. IUPAC: 3-chloro-5-thiophen-2-yl-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-2-carboxylic acid.
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