N-(4-bromo-3-methylphenyl)-3-(2-propanamido-1,3-benzothiazol-6-yl)propanamide
Chemical Structure Depiction of
N-(4-bromo-3-methylphenyl)-3-(2-propanamido-1,3-benzothiazol-6-yl)propanamide
N-(4-bromo-3-methylphenyl)-3-(2-propanamido-1,3-benzothiazol-6-yl)propanamide
Compound characteristics
| Compound ID: | F222-1204 |
| Compound Name: | N-(4-bromo-3-methylphenyl)-3-(2-propanamido-1,3-benzothiazol-6-yl)propanamide |
| Molecular Weight: | 446.36 |
| Molecular Formula: | C20 H20 Br N3 O2 S |
| Smiles: | CCC(Nc1nc2ccc(CCC(Nc3ccc(c(C)c3)[Br])=O)cc2s1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.9973 |
| logD: | 4.997 |
| logSw: | -4.6329 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 56.027 |
| InChI Key: | SJILIBUVRDBPDP-UHFFFAOYSA-N |