N-(6-{3-[4-(5-chloro-2-methylphenyl)piperazin-1-yl]-3-oxopropyl}-1,3-benzothiazol-2-yl)butanamide
Chemical Structure Depiction of
N-(6-{3-[4-(5-chloro-2-methylphenyl)piperazin-1-yl]-3-oxopropyl}-1,3-benzothiazol-2-yl)butanamide
N-(6-{3-[4-(5-chloro-2-methylphenyl)piperazin-1-yl]-3-oxopropyl}-1,3-benzothiazol-2-yl)butanamide
Compound characteristics
| Compound ID: | F222-0678 |
| Compound Name: | N-(6-{3-[4-(5-chloro-2-methylphenyl)piperazin-1-yl]-3-oxopropyl}-1,3-benzothiazol-2-yl)butanamide |
| Molecular Weight: | 485.05 |
| Molecular Formula: | C25 H29 Cl N4 O2 S |
| Smiles: | CCCC(Nc1nc2ccc(CCC(N3CCN(CC3)c3cc(ccc3C)[Cl])=O)cc2s1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.5109 |
| logD: | 5.5108 |
| logSw: | -5.7872 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 52.229 |
| InChI Key: | NAQBMFYVEBNFKO-UHFFFAOYSA-N |