N-{6-[3-(azepan-1-yl)-3-oxopropyl]-1,3-benzothiazol-2-yl}propanamide
Chemical Structure Depiction of
N-{6-[3-(azepan-1-yl)-3-oxopropyl]-1,3-benzothiazol-2-yl}propanamide
N-{6-[3-(azepan-1-yl)-3-oxopropyl]-1,3-benzothiazol-2-yl}propanamide
Compound characteristics
| Compound ID: | F222-1157 |
| Compound Name: | N-{6-[3-(azepan-1-yl)-3-oxopropyl]-1,3-benzothiazol-2-yl}propanamide |
| Molecular Weight: | 359.49 |
| Molecular Formula: | C19 H25 N3 O2 S |
| Smiles: | CCC(Nc1nc2ccc(CCC(N3CCCCCC3)=O)cc2s1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.6117 |
| logD: | 3.6117 |
| logSw: | -3.7137 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 49.601 |
| InChI Key: | QJPMPYDLCYGCFD-UHFFFAOYSA-N |