2-{1-[(3,4-dimethylphenyl)methyl]-1H-pyrrol-2-yl}-N-(6-methoxy-1,3-benzothiazol-2-yl)-2-oxoacetamide
Chemical Structure Depiction of
2-{1-[(3,4-dimethylphenyl)methyl]-1H-pyrrol-2-yl}-N-(6-methoxy-1,3-benzothiazol-2-yl)-2-oxoacetamide
2-{1-[(3,4-dimethylphenyl)methyl]-1H-pyrrol-2-yl}-N-(6-methoxy-1,3-benzothiazol-2-yl)-2-oxoacetamide
Compound characteristics
| Compound ID: | L793-4727 |
| Compound Name: | 2-{1-[(3,4-dimethylphenyl)methyl]-1H-pyrrol-2-yl}-N-(6-methoxy-1,3-benzothiazol-2-yl)-2-oxoacetamide |
| Molecular Weight: | 419.5 |
| Molecular Formula: | C23 H21 N3 O3 S |
| Smiles: | Cc1ccc(Cn2cccc2C(C(Nc2nc3ccc(cc3s2)OC)=O)=O)cc1C |
| Stereo: | ACHIRAL |
| logP: | 5.8294 |
| logD: | 5.8276 |
| logSw: | -5.457 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.963 |
| InChI Key: | VKHBBTZIJQTIJZ-UHFFFAOYSA-N |