N-{3-[4-(2,5-dimethylphenyl)piperazin-1-yl]propyl}-2-(4-methylpiperidin-1-yl)-1,3-benzothiazole-6-carboxamide
Chemical Structure Depiction of
N-{3-[4-(2,5-dimethylphenyl)piperazin-1-yl]propyl}-2-(4-methylpiperidin-1-yl)-1,3-benzothiazole-6-carboxamide
N-{3-[4-(2,5-dimethylphenyl)piperazin-1-yl]propyl}-2-(4-methylpiperidin-1-yl)-1,3-benzothiazole-6-carboxamide
Compound characteristics
| Compound ID: | C858-1104 |
| Compound Name: | N-{3-[4-(2,5-dimethylphenyl)piperazin-1-yl]propyl}-2-(4-methylpiperidin-1-yl)-1,3-benzothiazole-6-carboxamide |
| Molecular Weight: | 505.73 |
| Molecular Formula: | C29 H39 N5 O S |
| Smiles: | CC1CCN(CC1)c1nc2ccc(cc2s1)C(NCCCN1CCN(CC1)c1cc(C)ccc1C)=O |
| Stereo: | ACHIRAL |
| logP: | 5.8593 |
| logD: | 4.7128 |
| logSw: | -5.3558 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 44.423 |
| InChI Key: | VYIYIQXHQKRQAQ-UHFFFAOYSA-N |