3-[5-amino-4-(1,3-benzothiazol-2-yl)-3-oxo-2,3-dihydro-1H-pyrrol-1-yl]-N-[(4-ethylphenyl)methyl]benzamide
Chemical Structure Depiction of
3-[5-amino-4-(1,3-benzothiazol-2-yl)-3-oxo-2,3-dihydro-1H-pyrrol-1-yl]-N-[(4-ethylphenyl)methyl]benzamide
3-[5-amino-4-(1,3-benzothiazol-2-yl)-3-oxo-2,3-dihydro-1H-pyrrol-1-yl]-N-[(4-ethylphenyl)methyl]benzamide
Compound characteristics
| Compound ID: | F187-0674 |
| Compound Name: | 3-[5-amino-4-(1,3-benzothiazol-2-yl)-3-oxo-2,3-dihydro-1H-pyrrol-1-yl]-N-[(4-ethylphenyl)methyl]benzamide |
| Molecular Weight: | 468.58 |
| Molecular Formula: | C27 H24 N4 O2 S |
| Smiles: | CCc1ccc(CNC(c2cccc(c2)N2CC(C(=C2N)c2nc3ccccc3s2)=O)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 4.8374 |
| logD: | 4.8374 |
| logSw: | -4.7174 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 70.833 |
| InChI Key: | JSJCREJWVKILEM-UHFFFAOYSA-N |