2-(3-methoxy-4-nitro-1H-pyrazol-1-yl)-4-(thiophen-2-yl)-6-(trifluoromethyl)pyrimidine
Chemical Structure Depiction of
2-(3-methoxy-4-nitro-1H-pyrazol-1-yl)-4-(thiophen-2-yl)-6-(trifluoromethyl)pyrimidine
2-(3-methoxy-4-nitro-1H-pyrazol-1-yl)-4-(thiophen-2-yl)-6-(trifluoromethyl)pyrimidine
Compound characteristics
| Compound ID: | C226-4651 |
| Compound Name: | 2-(3-methoxy-4-nitro-1H-pyrazol-1-yl)-4-(thiophen-2-yl)-6-(trifluoromethyl)pyrimidine |
| Molecular Weight: | 371.29 |
| Molecular Formula: | C13 H8 F3 N5 O3 S |
| Smiles: | COc1c(cn(c2nc(cc(C(F)(F)F)n2)c2cccs2)n1)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 3.9692 |
| logD: | 3.9692 |
| logSw: | -4.2476 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 73.999 |
| InChI Key: | CLWOCBVHJVEUMQ-UHFFFAOYSA-N |