5-amino-4-(1H-benzimidazol-2-yl)-1-(3-chloro-4-methoxyphenyl)-1,2-dihydro-3H-pyrrol-3-one
Chemical Structure Depiction of
5-amino-4-(1H-benzimidazol-2-yl)-1-(3-chloro-4-methoxyphenyl)-1,2-dihydro-3H-pyrrol-3-one
5-amino-4-(1H-benzimidazol-2-yl)-1-(3-chloro-4-methoxyphenyl)-1,2-dihydro-3H-pyrrol-3-one
Compound characteristics
| Compound ID: | D086-0333 |
| Compound Name: | 5-amino-4-(1H-benzimidazol-2-yl)-1-(3-chloro-4-methoxyphenyl)-1,2-dihydro-3H-pyrrol-3-one |
| Molecular Weight: | 354.79 |
| Molecular Formula: | C18 H15 Cl N4 O2 |
| Smiles: | COc1ccc(cc1[Cl])N1CC(C(=C1N)c1nc2ccccc2[nH]1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.7758 |
| logD: | 2.7758 |
| logSw: | -3.3832 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 63.621 |
| InChI Key: | FADISIAYCGVDKH-UHFFFAOYSA-N |