propan-2-yl 4,5-dimethyl-2-{[5-(thiophen-2-yl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carbonyl]amino}thiophene-3-carboxylate
Chemical Structure Depiction of
propan-2-yl 4,5-dimethyl-2-{[5-(thiophen-2-yl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carbonyl]amino}thiophene-3-carboxylate
propan-2-yl 4,5-dimethyl-2-{[5-(thiophen-2-yl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carbonyl]amino}thiophene-3-carboxylate
Compound characteristics
| Compound ID: | Y500-5538 |
| Compound Name: | propan-2-yl 4,5-dimethyl-2-{[5-(thiophen-2-yl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carbonyl]amino}thiophene-3-carboxylate |
| Molecular Weight: | 508.54 |
| Molecular Formula: | C22 H19 F3 N4 O3 S2 |
| Smiles: | CC(C)OC(c1c(C)c(C)sc1NC(c1cc2nc(cc(C(F)(F)F)n2n1)c1cccs1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.8245 |
| logD: | 3.1366 |
| logSw: | -5.5603 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 62.734 |
| InChI Key: | GKBGJLBEYGGWJS-UHFFFAOYSA-N |