5-amino-4-(1,3-benzothiazol-2-yl)-1-(2-chloro-4,6-dimethoxyphenyl)-1,2-dihydro-3H-pyrrol-3-one
Chemical Structure Depiction of
5-amino-4-(1,3-benzothiazol-2-yl)-1-(2-chloro-4,6-dimethoxyphenyl)-1,2-dihydro-3H-pyrrol-3-one
5-amino-4-(1,3-benzothiazol-2-yl)-1-(2-chloro-4,6-dimethoxyphenyl)-1,2-dihydro-3H-pyrrol-3-one
Compound characteristics
| Compound ID: | F187-0180 |
| Compound Name: | 5-amino-4-(1,3-benzothiazol-2-yl)-1-(2-chloro-4,6-dimethoxyphenyl)-1,2-dihydro-3H-pyrrol-3-one |
| Molecular Weight: | 401.87 |
| Molecular Formula: | C19 H16 Cl N3 O3 S |
| Smiles: | COc1cc(c(c(c1)[Cl])N1CC(C(=C1N)c1nc2ccccc2s1)=O)OC |
| Stereo: | ACHIRAL |
| logP: | 3.8323 |
| logD: | 3.8323 |
| logSw: | -4.2785 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 60.992 |
| InChI Key: | YKYDTRVXKLBKQE-UHFFFAOYSA-N |