N-[(4-methylphenyl)methyl]-2-[4-(2-methylpropanoyl)piperazin-1-yl]-4,5,6,7-tetrahydro-1,3-benzothiazole-6-carboxamide
Chemical Structure Depiction of
N-[(4-methylphenyl)methyl]-2-[4-(2-methylpropanoyl)piperazin-1-yl]-4,5,6,7-tetrahydro-1,3-benzothiazole-6-carboxamide
N-[(4-methylphenyl)methyl]-2-[4-(2-methylpropanoyl)piperazin-1-yl]-4,5,6,7-tetrahydro-1,3-benzothiazole-6-carboxamide
Compound characteristics
| Compound ID: | T409-0340 |
| Compound Name: | N-[(4-methylphenyl)methyl]-2-[4-(2-methylpropanoyl)piperazin-1-yl]-4,5,6,7-tetrahydro-1,3-benzothiazole-6-carboxamide |
| Molecular Weight: | 440.61 |
| Molecular Formula: | C24 H32 N4 O2 S |
| Smiles: | CC(C)C(N1CCN(CC1)c1nc2CCC(Cc2s1)C(NCc1ccc(C)cc1)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.7725 |
| logD: | 3.6668 |
| logSw: | -3.7377 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.074 |
| InChI Key: | LOUKSXUCYVUWJP-LJQANCHMSA-N |