N-[(3'-cyano-1'H-spiro[cyclohexane-1,2'-naphthalen]-4'-yl)carbamothioyl]benzamide
Chemical Structure Depiction of
N-[(3'-cyano-1'H-spiro[cyclohexane-1,2'-naphthalen]-4'-yl)carbamothioyl]benzamide
N-[(3'-cyano-1'H-spiro[cyclohexane-1,2'-naphthalen]-4'-yl)carbamothioyl]benzamide
Compound characteristics
| Compound ID: | 8005-9959 |
| Compound Name: | N-[(3'-cyano-1'H-spiro[cyclohexane-1,2'-naphthalen]-4'-yl)carbamothioyl]benzamide |
| Molecular Weight: | 401.53 |
| Molecular Formula: | C24 H23 N3 O S |
| Smiles: | C1CCC2(CC1)Cc1ccccc1C(=C2C#N)NC(NC(c1ccccc1)=O)=S |
| Stereo: | ACHIRAL |
| logP: | 4.9873 |
| logD: | 4.7146 |
| logSw: | -4.772 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 50.336 |
| InChI Key: | VGWZOQNOVYKIDA-UHFFFAOYSA-N |