ethyl 5-{[5,7-bis(difluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carbonyl]amino}-4-cyano-3-methylthiophene-2-carboxylate
Chemical Structure Depiction of
ethyl 5-{[5,7-bis(difluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carbonyl]amino}-4-cyano-3-methylthiophene-2-carboxylate
ethyl 5-{[5,7-bis(difluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carbonyl]amino}-4-cyano-3-methylthiophene-2-carboxylate
Compound characteristics
| Compound ID: | Y502-6184 |
| Compound Name: | ethyl 5-{[5,7-bis(difluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carbonyl]amino}-4-cyano-3-methylthiophene-2-carboxylate |
| Molecular Weight: | 455.39 |
| Molecular Formula: | C18 H13 F4 N5 O3 S |
| Smiles: | CCOC(c1c(C)c(C#N)c(NC(c2cc3nc(cc(C(F)F)n3n2)C(F)F)=O)s1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.7809 |
| logD: | 1.3283 |
| logSw: | -3.1274 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 79.365 |
| InChI Key: | AQQWHWVGULPXRF-UHFFFAOYSA-N |