N-{6-[3-({[4-(dimethylamino)phenyl]methyl}amino)-3-oxopropyl]-1,3-benzothiazol-2-yl}butanamide
Chemical Structure Depiction of
N-{6-[3-({[4-(dimethylamino)phenyl]methyl}amino)-3-oxopropyl]-1,3-benzothiazol-2-yl}butanamide
N-{6-[3-({[4-(dimethylamino)phenyl]methyl}amino)-3-oxopropyl]-1,3-benzothiazol-2-yl}butanamide
Compound characteristics
| Compound ID: | F222-0828 |
| Compound Name: | N-{6-[3-({[4-(dimethylamino)phenyl]methyl}amino)-3-oxopropyl]-1,3-benzothiazol-2-yl}butanamide |
| Molecular Weight: | 424.56 |
| Molecular Formula: | C23 H28 N4 O2 S |
| Smiles: | CCCC(Nc1nc2ccc(CCC(NCc3ccc(cc3)N(C)C)=O)cc2s1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.0902 |
| logD: | 4.0748 |
| logSw: | -4.1144 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 60.154 |
| InChI Key: | ZNKFYLXNHMFSPY-UHFFFAOYSA-N |