2-[(7-ethyl-8-oxo-3-oxa-7,11-diazaspiro[5.6]dodecan-11-yl)methyl]benzonitrile
Chemical Structure Depiction of
2-[(7-ethyl-8-oxo-3-oxa-7,11-diazaspiro[5.6]dodecan-11-yl)methyl]benzonitrile
2-[(7-ethyl-8-oxo-3-oxa-7,11-diazaspiro[5.6]dodecan-11-yl)methyl]benzonitrile
Compound characteristics
| Compound ID: | S671-0465 |
| Compound Name: | 2-[(7-ethyl-8-oxo-3-oxa-7,11-diazaspiro[5.6]dodecan-11-yl)methyl]benzonitrile |
| Molecular Weight: | 327.42 |
| Molecular Formula: | C19 H25 N3 O2 |
| Smiles: | CCN1C(CCN(Cc2ccccc2C#N)CC12CCOCC2)=O |
| Stereo: | ACHIRAL |
| logP: | 1.9902 |
| logD: | 1.828 |
| logSw: | -2.4704 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 45.121 |
| InChI Key: | BLGJNPGIQORPOP-UHFFFAOYSA-N |