N-[(3-methylphenyl)methyl]-3-(2-propanamido-1,3-benzothiazol-6-yl)propanamide
Chemical Structure Depiction of
N-[(3-methylphenyl)methyl]-3-(2-propanamido-1,3-benzothiazol-6-yl)propanamide
N-[(3-methylphenyl)methyl]-3-(2-propanamido-1,3-benzothiazol-6-yl)propanamide
Compound characteristics
| Compound ID: | F222-1191 |
| Compound Name: | N-[(3-methylphenyl)methyl]-3-(2-propanamido-1,3-benzothiazol-6-yl)propanamide |
| Molecular Weight: | 381.5 |
| Molecular Formula: | C21 H23 N3 O2 S |
| Smiles: | CCC(Nc1nc2ccc(CCC(NCc3cccc(C)c3)=O)cc2s1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.2115 |
| logD: | 4.2115 |
| logSw: | -4.2413 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 57.349 |
| InChI Key: | TYSHGQKBKFSHON-UHFFFAOYSA-N |