4-(1,2-benzothiazole-3-carbonyl)-N-(4-bromo-2-fluorophenyl)piperazine-1-carboxamide
Chemical Structure Depiction of
4-(1,2-benzothiazole-3-carbonyl)-N-(4-bromo-2-fluorophenyl)piperazine-1-carboxamide
4-(1,2-benzothiazole-3-carbonyl)-N-(4-bromo-2-fluorophenyl)piperazine-1-carboxamide
Compound characteristics
| Compound ID: | G795-0740 |
| Compound Name: | 4-(1,2-benzothiazole-3-carbonyl)-N-(4-bromo-2-fluorophenyl)piperazine-1-carboxamide |
| Molecular Weight: | 463.33 |
| Molecular Formula: | C19 H16 Br F N4 O2 S |
| Smiles: | C1CN(CCN1C(c1c2ccccc2sn1)=O)C(Nc1ccc(cc1F)[Br])=O |
| Stereo: | ACHIRAL |
| logP: | 4.1019 |
| logD: | 4.1014 |
| logSw: | -4.2502 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 52.456 |
| InChI Key: | XCOALHGGYYWNOU-UHFFFAOYSA-N |