2-{4-[2-(2-fluoroanilino)-1,3-thiazole-4-carbonyl]piperazin-1-yl}-1-[4-(4-nitrophenyl)piperazin-1-yl]ethan-1-one
Chemical Structure Depiction of
2-{4-[2-(2-fluoroanilino)-1,3-thiazole-4-carbonyl]piperazin-1-yl}-1-[4-(4-nitrophenyl)piperazin-1-yl]ethan-1-one
2-{4-[2-(2-fluoroanilino)-1,3-thiazole-4-carbonyl]piperazin-1-yl}-1-[4-(4-nitrophenyl)piperazin-1-yl]ethan-1-one
Compound characteristics
| Compound ID: | V007-6085 |
| Compound Name: | 2-{4-[2-(2-fluoroanilino)-1,3-thiazole-4-carbonyl]piperazin-1-yl}-1-[4-(4-nitrophenyl)piperazin-1-yl]ethan-1-one |
| Molecular Weight: | 553.61 |
| Molecular Formula: | C26 H28 F N7 O4 S |
| Salt: | not_available |
| Smiles: | C1CN(CCN1CC(N1CCN(CC1)c1ccc(cc1)[N+]([O-])=O)=O)C(c1csc(Nc2ccccc2F)n1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.3277 |
| logD: | 3.3275 |
| logSw: | -3.5432 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 91.723 |
| InChI Key: | VXRNZHMSNIXMRU-UHFFFAOYSA-N |