N-benzyl-2-{9-[(3-cyanophenyl)methyl]-1-oxa-9-azaspiro[5.5]undecan-4-yl}acetamide
Chemical Structure Depiction of
N-benzyl-2-{9-[(3-cyanophenyl)methyl]-1-oxa-9-azaspiro[5.5]undecan-4-yl}acetamide
N-benzyl-2-{9-[(3-cyanophenyl)methyl]-1-oxa-9-azaspiro[5.5]undecan-4-yl}acetamide
Compound characteristics
| Compound ID: | S511-1998 |
| Compound Name: | N-benzyl-2-{9-[(3-cyanophenyl)methyl]-1-oxa-9-azaspiro[5.5]undecan-4-yl}acetamide |
| Molecular Weight: | 417.55 |
| Molecular Formula: | C26 H31 N3 O2 |
| Smiles: | C1COC2(CCN(CC2)Cc2cccc(C#N)c2)CC1CC(NCc1ccccc1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.3469 |
| logD: | 3.2082 |
| logSw: | -3.5508 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 51.829 |
| InChI Key: | DFQMUHYUTLKZCQ-JOCHJYFZSA-N |