3-(2-acetamido-1,3-benzothiazol-6-yl)-N-(4-bromo-3-methylphenyl)propanamide
Chemical Structure Depiction of
3-(2-acetamido-1,3-benzothiazol-6-yl)-N-(4-bromo-3-methylphenyl)propanamide
3-(2-acetamido-1,3-benzothiazol-6-yl)-N-(4-bromo-3-methylphenyl)propanamide
Compound characteristics
| Compound ID: | F222-0414 |
| Compound Name: | 3-(2-acetamido-1,3-benzothiazol-6-yl)-N-(4-bromo-3-methylphenyl)propanamide |
| Molecular Weight: | 432.34 |
| Molecular Formula: | C19 H18 Br N3 O2 S |
| Smiles: | CC(Nc1nc2ccc(CCC(Nc3ccc(c(C)c3)[Br])=O)cc2s1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.7058 |
| logD: | 4.7055 |
| logSw: | -4.4434 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 56.139 |
| InChI Key: | ZMWXFKICGGCZDX-UHFFFAOYSA-N |