2-methyl-N-[4-methyl-1-oxo-1-(4-phenyl-3,6-dihydropyridin-1(2H)-yl)pentan-2-yl]-1,3-benzothiazole-6-sulfonamide
Chemical Structure Depiction of
2-methyl-N-[4-methyl-1-oxo-1-(4-phenyl-3,6-dihydropyridin-1(2H)-yl)pentan-2-yl]-1,3-benzothiazole-6-sulfonamide
2-methyl-N-[4-methyl-1-oxo-1-(4-phenyl-3,6-dihydropyridin-1(2H)-yl)pentan-2-yl]-1,3-benzothiazole-6-sulfonamide
Compound characteristics
| Compound ID: | C583-0136 |
| Compound Name: | 2-methyl-N-[4-methyl-1-oxo-1-(4-phenyl-3,6-dihydropyridin-1(2H)-yl)pentan-2-yl]-1,3-benzothiazole-6-sulfonamide |
| Molecular Weight: | 483.65 |
| Molecular Formula: | C25 H29 N3 O3 S2 |
| Smiles: | CC(C)CC(C(N1CCC(=CC1)c1ccccc1)=O)NS(c1ccc2c(c1)sc(C)n2)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.2801 |
| logD: | 5.2794 |
| logSw: | -5.1819 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 68.016 |
| InChI Key: | ROBPCPBOUOXHFU-QHCPKHFHSA-N |