4-[5-amino-4-(1,3-benzothiazol-2-yl)-3-oxo-2,3-dihydro-1H-pyrrol-1-yl]-N-[3-(pyrrolidin-1-yl)propyl]benzamide
Chemical Structure Depiction of
4-[5-amino-4-(1,3-benzothiazol-2-yl)-3-oxo-2,3-dihydro-1H-pyrrol-1-yl]-N-[3-(pyrrolidin-1-yl)propyl]benzamide
4-[5-amino-4-(1,3-benzothiazol-2-yl)-3-oxo-2,3-dihydro-1H-pyrrol-1-yl]-N-[3-(pyrrolidin-1-yl)propyl]benzamide
Compound characteristics
| Compound ID: | F187-0485 |
| Compound Name: | 4-[5-amino-4-(1,3-benzothiazol-2-yl)-3-oxo-2,3-dihydro-1H-pyrrol-1-yl]-N-[3-(pyrrolidin-1-yl)propyl]benzamide |
| Molecular Weight: | 461.59 |
| Molecular Formula: | C25 H27 N5 O2 S |
| Smiles: | C1CCN(C1)CCCNC(c1ccc(cc1)N1CC(C(=C1N)c1nc2ccccc2s1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.7558 |
| logD: | -0.2767 |
| logSw: | -3.2937 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 75.023 |
| InChI Key: | ZGBJVVXWOLZBLX-UHFFFAOYSA-N |