2-[4-(2-methylpropanoyl)piperazin-1-yl]-N-[(pyridin-3-yl)methyl]-4,5,6,7-tetrahydro-1,3-benzothiazole-6-carboxamide
Chemical Structure Depiction of
2-[4-(2-methylpropanoyl)piperazin-1-yl]-N-[(pyridin-3-yl)methyl]-4,5,6,7-tetrahydro-1,3-benzothiazole-6-carboxamide
2-[4-(2-methylpropanoyl)piperazin-1-yl]-N-[(pyridin-3-yl)methyl]-4,5,6,7-tetrahydro-1,3-benzothiazole-6-carboxamide
Compound characteristics
| Compound ID: | T409-0299 |
| Compound Name: | 2-[4-(2-methylpropanoyl)piperazin-1-yl]-N-[(pyridin-3-yl)methyl]-4,5,6,7-tetrahydro-1,3-benzothiazole-6-carboxamide |
| Molecular Weight: | 427.57 |
| Molecular Formula: | C22 H29 N5 O2 S |
| Smiles: | CC(C)C(N1CCN(CC1)c1nc2CCC(Cc2s1)C(NCc1cccnc1)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.1214 |
| logD: | 2.0157 |
| logSw: | -2.1098 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 65.592 |
| InChI Key: | KWYXCSBTEPVCMO-QGZVFWFLSA-N |