N-{6-[3-(4-acetamidoanilino)-3-oxopropyl]-1,3-benzothiazol-2-yl}butanamide
Chemical Structure Depiction of
N-{6-[3-(4-acetamidoanilino)-3-oxopropyl]-1,3-benzothiazol-2-yl}butanamide
N-{6-[3-(4-acetamidoanilino)-3-oxopropyl]-1,3-benzothiazol-2-yl}butanamide
Compound characteristics
| Compound ID: | F222-0745 |
| Compound Name: | N-{6-[3-(4-acetamidoanilino)-3-oxopropyl]-1,3-benzothiazol-2-yl}butanamide |
| Molecular Weight: | 424.52 |
| Molecular Formula: | C22 H24 N4 O3 S |
| Smiles: | CCCC(Nc1nc2ccc(CCC(Nc3ccc(cc3)NC(C)=O)=O)cc2s1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.5012 |
| logD: | 3.5011 |
| logSw: | -3.7194 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 79.289 |
| InChI Key: | HIPIRXSUEDOEND-UHFFFAOYSA-N |