5-[(1-acetyl-5-oxo-2,5-dihydro-1H-pyrrol-3-yl)amino]-2-methoxybenzonitrile
Chemical Structure Depiction of
5-[(1-acetyl-5-oxo-2,5-dihydro-1H-pyrrol-3-yl)amino]-2-methoxybenzonitrile
5-[(1-acetyl-5-oxo-2,5-dihydro-1H-pyrrol-3-yl)amino]-2-methoxybenzonitrile
Compound characteristics
| Compound ID: | 8020-8337 |
| Compound Name: | 5-[(1-acetyl-5-oxo-2,5-dihydro-1H-pyrrol-3-yl)amino]-2-methoxybenzonitrile |
| Molecular Weight: | 271.27 |
| Molecular Formula: | C14 H13 N3 O3 |
| Smiles: | CC(N1CC(=CC1=O)Nc1ccc(c(C#N)c1)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 0.598 |
| logD: | 0.3926 |
| logSw: | -2.2909 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 65.096 |
| InChI Key: | FVSZAEKFYQLFQE-UHFFFAOYSA-N |