ethyl 5-carbamoyl-2-({7-[chloro(difluoro)methyl]-5-(thiophen-2-yl)pyrazolo[1,5-a]pyrimidine-2-carbonyl}amino)-4-methylthiophene-3-carboxylate
Chemical Structure Depiction of
ethyl 5-carbamoyl-2-({7-[chloro(difluoro)methyl]-5-(thiophen-2-yl)pyrazolo[1,5-a]pyrimidine-2-carbonyl}amino)-4-methylthiophene-3-carboxylate
ethyl 5-carbamoyl-2-({7-[chloro(difluoro)methyl]-5-(thiophen-2-yl)pyrazolo[1,5-a]pyrimidine-2-carbonyl}amino)-4-methylthiophene-3-carboxylate
Compound characteristics
| Compound ID: | 8012-9932 |
| Compound Name: | ethyl 5-carbamoyl-2-({7-[chloro(difluoro)methyl]-5-(thiophen-2-yl)pyrazolo[1,5-a]pyrimidine-2-carbonyl}amino)-4-methylthiophene-3-carboxylate |
| Molecular Weight: | 539.97 |
| Molecular Formula: | C21 H16 Cl F2 N5 O4 S2 |
| Smiles: | CCOC(c1c(C)c(C(N)=O)sc1NC(c1cc2nc(cc(C(F)(F)[Cl])n2n1)c1cccs1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.1739 |
| logD: | 0.6806 |
| logSw: | -4.7992 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 97.114 |
| InChI Key: | KMFPOPXWHCLZBR-UHFFFAOYSA-N |