4-[3-(4-methoxyphenyl)-4,6-dioxo-2-phenylhexahydro-5H-pyrrolo[3,4-d][1,2]oxazol-5-yl]benzonitrile
Chemical Structure Depiction of
4-[3-(4-methoxyphenyl)-4,6-dioxo-2-phenylhexahydro-5H-pyrrolo[3,4-d][1,2]oxazol-5-yl]benzonitrile
4-[3-(4-methoxyphenyl)-4,6-dioxo-2-phenylhexahydro-5H-pyrrolo[3,4-d][1,2]oxazol-5-yl]benzonitrile
Compound characteristics
| Compound ID: | 8013-2565 |
| Compound Name: | 4-[3-(4-methoxyphenyl)-4,6-dioxo-2-phenylhexahydro-5H-pyrrolo[3,4-d][1,2]oxazol-5-yl]benzonitrile |
| Molecular Weight: | 425.44 |
| Molecular Formula: | C25 H19 N3 O4 |
| Smiles: | COc1ccc(cc1)C1C2C(C(N(C2=O)c2ccc(C#N)cc2)=O)ON1c1ccccc1 |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 2.8409 |
| logD: | 2.8409 |
| logSw: | -3.4043 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 68.233 |
| InChI Key: | RPZFCVKTPLFZJU-UHFFFAOYSA-N |