2-amino-1-[2-(4-chlorophenyl)ethyl]-5-oxo-4,5-dihydro-1H-pyrrole-3-carbonitrile
Chemical Structure Depiction of
2-amino-1-[2-(4-chlorophenyl)ethyl]-5-oxo-4,5-dihydro-1H-pyrrole-3-carbonitrile
2-amino-1-[2-(4-chlorophenyl)ethyl]-5-oxo-4,5-dihydro-1H-pyrrole-3-carbonitrile
Compound characteristics
| Compound ID: | 8018-8465 |
| Compound Name: | 2-amino-1-[2-(4-chlorophenyl)ethyl]-5-oxo-4,5-dihydro-1H-pyrrole-3-carbonitrile |
| Molecular Weight: | 261.71 |
| Molecular Formula: | C13 H12 Cl N3 O |
| Smiles: | C(CN1C(=C(CC1=O)C#N)N)c1ccc(cc1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 1.8203 |
| logD: | 1.82 |
| logSw: | -2.4937 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 54.088 |
| InChI Key: | KUSOHWNIPSYURR-UHFFFAOYSA-N |