2-[4-(2-methylpropanoyl)piperazin-1-yl]-N-[2-(pyridin-4-yl)ethyl]-4,5,6,7-tetrahydro-1,3-benzothiazole-6-carboxamide
Chemical Structure Depiction of
2-[4-(2-methylpropanoyl)piperazin-1-yl]-N-[2-(pyridin-4-yl)ethyl]-4,5,6,7-tetrahydro-1,3-benzothiazole-6-carboxamide
2-[4-(2-methylpropanoyl)piperazin-1-yl]-N-[2-(pyridin-4-yl)ethyl]-4,5,6,7-tetrahydro-1,3-benzothiazole-6-carboxamide
Compound characteristics
Compound ID: | T409-0343 |
Compound Name: | 2-[4-(2-methylpropanoyl)piperazin-1-yl]-N-[2-(pyridin-4-yl)ethyl]-4,5,6,7-tetrahydro-1,3-benzothiazole-6-carboxamide |
Molecular Weight: | 441.59 |
Molecular Formula: | C23 H31 N5 O2 S |
Smiles: | CC(C)C(N1CCN(CC1)c1nc2CCC(Cc2s1)C(NCCc1ccncc1)=O)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 2.1661 |
logD: | 2.0604 |
logSw: | -2.4611 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 65.343 |
InChI Key: | XXHIVRRFYZKGBP-GOSISDBHSA-N |