N-benzyl-2-[4-(2-methylpropanoyl)piperazin-1-yl]-4,5,6,7-tetrahydro-1,3-benzothiazole-6-carboxamide
Chemical Structure Depiction of
N-benzyl-2-[4-(2-methylpropanoyl)piperazin-1-yl]-4,5,6,7-tetrahydro-1,3-benzothiazole-6-carboxamide
N-benzyl-2-[4-(2-methylpropanoyl)piperazin-1-yl]-4,5,6,7-tetrahydro-1,3-benzothiazole-6-carboxamide
Compound characteristics
| Compound ID: | T409-0305 |
| Compound Name: | N-benzyl-2-[4-(2-methylpropanoyl)piperazin-1-yl]-4,5,6,7-tetrahydro-1,3-benzothiazole-6-carboxamide |
| Molecular Weight: | 426.58 |
| Molecular Formula: | C23 H30 N4 O2 S |
| Smiles: | CC(C)C(N1CCN(CC1)c1nc2CCC(Cc2s1)C(NCc1ccccc1)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.3491 |
| logD: | 3.2434 |
| logSw: | -3.3989 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.074 |
| InChI Key: | QOCGVNSHBVAWTI-GOSISDBHSA-N |