N-[2-(propan-2-yl)phenyl]-4-[2-({[2-(propan-2-yl)phenyl]carbamothioyl}amino)ethyl]piperazine-1-carbothioamide
Chemical Structure Depiction of
N-[2-(propan-2-yl)phenyl]-4-[2-({[2-(propan-2-yl)phenyl]carbamothioyl}amino)ethyl]piperazine-1-carbothioamide
N-[2-(propan-2-yl)phenyl]-4-[2-({[2-(propan-2-yl)phenyl]carbamothioyl}amino)ethyl]piperazine-1-carbothioamide
Compound characteristics
| Compound ID: | 8015-2347 |
| Compound Name: | N-[2-(propan-2-yl)phenyl]-4-[2-({[2-(propan-2-yl)phenyl]carbamothioyl}amino)ethyl]piperazine-1-carbothioamide |
| Molecular Weight: | 483.74 |
| Molecular Formula: | C26 H37 N5 S2 |
| Smiles: | CC(C)c1ccccc1NC(NCCN1CCN(CC1)C(Nc1ccccc1C(C)C)=S)=S |
| Stereo: | ACHIRAL |
| logP: | 5.2183 |
| logD: | 3.7217 |
| logSw: | -5.095 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 33.518 |
| InChI Key: | UTSJEODIZLQFCL-UHFFFAOYSA-N |