2-(4-acetylpiperazin-1-yl)-N-(2-chloro-4-fluorophenyl)-4,5,6,7-tetrahydro-1,3-benzothiazole-6-carboxamide
Chemical Structure Depiction of
2-(4-acetylpiperazin-1-yl)-N-(2-chloro-4-fluorophenyl)-4,5,6,7-tetrahydro-1,3-benzothiazole-6-carboxamide
2-(4-acetylpiperazin-1-yl)-N-(2-chloro-4-fluorophenyl)-4,5,6,7-tetrahydro-1,3-benzothiazole-6-carboxamide
Compound characteristics
| Compound ID: | T409-0070 |
| Compound Name: | 2-(4-acetylpiperazin-1-yl)-N-(2-chloro-4-fluorophenyl)-4,5,6,7-tetrahydro-1,3-benzothiazole-6-carboxamide |
| Molecular Weight: | 436.93 |
| Molecular Formula: | C20 H22 Cl F N4 O2 S |
| Smiles: | CC(N1CCN(CC1)c1nc2CCC(Cc2s1)C(Nc1ccc(cc1[Cl])F)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.5918 |
| logD: | 3.3341 |
| logSw: | -3.9103 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.522 |
| InChI Key: | XCMHYEGIHGDHMP-ZDUSSCGKSA-N |