3-[5-amino-4-(1,3-benzothiazol-2-yl)-3-oxo-2,3-dihydro-1H-pyrrol-1-yl]-N-[(2-chloro-4-fluorophenyl)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-[(2-chloro-4-fluorophenyl)methyl]benzamide
3-[5-amino-4-(1,3-benzothiazol-2-yl)-3-oxo-2,3-dihydro-1H-pyrrol-1-yl]-N-[(2-chloro-4-fluorophenyl)methyl]benzamide
Compound characteristics
| Compound ID: | F187-0659 |
| Compound Name: | 3-[5-amino-4-(1,3-benzothiazol-2-yl)-3-oxo-2,3-dihydro-1H-pyrrol-1-yl]-N-[(2-chloro-4-fluorophenyl)methyl]benzamide |
| Molecular Weight: | 492.96 |
| Molecular Formula: | C25 H18 Cl F N4 O2 S |
| Smiles: | C(c1ccc(cc1[Cl])F)NC(c1cccc(c1)N1CC(C(=C1N)c1nc2ccccc2s1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.9296 |
| logD: | 4.9296 |
| logSw: | -5.0718 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 70.833 |
| InChI Key: | DJXBXWOYWVJYEE-UHFFFAOYSA-N |