N-[2-(4-methylphenyl)ethyl]-N~2~-{1-[(4-methylphenyl)methyl]-1,4-diazaspiro[5.5]undecane-4-carbothioyl}glycinamide
Chemical Structure Depiction of
N-[2-(4-methylphenyl)ethyl]-N~2~-{1-[(4-methylphenyl)methyl]-1,4-diazaspiro[5.5]undecane-4-carbothioyl}glycinamide
N-[2-(4-methylphenyl)ethyl]-N~2~-{1-[(4-methylphenyl)methyl]-1,4-diazaspiro[5.5]undecane-4-carbothioyl}glycinamide
Compound characteristics
| Compound ID: | K786-6388 |
| Compound Name: | N-[2-(4-methylphenyl)ethyl]-N~2~-{1-[(4-methylphenyl)methyl]-1,4-diazaspiro[5.5]undecane-4-carbothioyl}glycinamide |
| Molecular Weight: | 492.73 |
| Molecular Formula: | C29 H40 N4 O S |
| Smiles: | Cc1ccc(CCNC(CNC(N2CCN(Cc3ccc(C)cc3)C3(CCCCC3)C2)=S)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 5.182 |
| logD: | 3.8315 |
| logSw: | -4.7458 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 39.813 |
| InChI Key: | VCXVTNUQSUZBOT-UHFFFAOYSA-N |