5-amino-4-(1,3-benzothiazol-2-yl)-1-(2,4,5-trichlorophenyl)-1,2-dihydro-3H-pyrrol-3-one
Chemical Structure Depiction of
5-amino-4-(1,3-benzothiazol-2-yl)-1-(2,4,5-trichlorophenyl)-1,2-dihydro-3H-pyrrol-3-one
5-amino-4-(1,3-benzothiazol-2-yl)-1-(2,4,5-trichlorophenyl)-1,2-dihydro-3H-pyrrol-3-one
Compound characteristics
| Compound ID: | D086-0225 |
| Compound Name: | 5-amino-4-(1,3-benzothiazol-2-yl)-1-(2,4,5-trichlorophenyl)-1,2-dihydro-3H-pyrrol-3-one |
| Molecular Weight: | 410.71 |
| Molecular Formula: | C17 H10 Cl3 N3 O S |
| Smiles: | C1C(C(=C(N)N1c1cc(c(cc1[Cl])[Cl])[Cl])c1nc2ccccc2s1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.1168 |
| logD: | 5.1168 |
| logSw: | -5.6656 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 46.119 |
| InChI Key: | RXUMXQFMGNZSJM-UHFFFAOYSA-N |