N-[6-(3-{[(3-chlorophenyl)methyl]amino}-3-oxopropyl)-1,3-benzothiazol-2-yl]butanamide
Chemical Structure Depiction of
N-[6-(3-{[(3-chlorophenyl)methyl]amino}-3-oxopropyl)-1,3-benzothiazol-2-yl]butanamide
N-[6-(3-{[(3-chlorophenyl)methyl]amino}-3-oxopropyl)-1,3-benzothiazol-2-yl]butanamide
Compound characteristics
| Compound ID: | F222-0620 |
| Compound Name: | N-[6-(3-{[(3-chlorophenyl)methyl]amino}-3-oxopropyl)-1,3-benzothiazol-2-yl]butanamide |
| Molecular Weight: | 415.94 |
| Molecular Formula: | C21 H22 Cl N3 O2 S |
| Smiles: | CCCC(Nc1nc2ccc(CCC(NCc3cccc(c3)[Cl])=O)cc2s1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.6976 |
| logD: | 4.6975 |
| logSw: | -4.7391 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 57.349 |
| InChI Key: | KDICLAODDNABBW-UHFFFAOYSA-N |