N~2~-{benzyl[(pyridin-3-yl)methyl]carbamothioyl}-N-cyclopentylglycinamide
Chemical Structure Depiction of
N~2~-{benzyl[(pyridin-3-yl)methyl]carbamothioyl}-N-cyclopentylglycinamide
N~2~-{benzyl[(pyridin-3-yl)methyl]carbamothioyl}-N-cyclopentylglycinamide
Compound characteristics
| Compound ID: | K784-4019 |
| Compound Name: | N~2~-{benzyl[(pyridin-3-yl)methyl]carbamothioyl}-N-cyclopentylglycinamide |
| Molecular Weight: | 382.53 |
| Molecular Formula: | C21 H26 N4 O S |
| Smiles: | C1CCC(C1)NC(CNC(N(Cc1ccccc1)Cc1cccnc1)=S)=O |
| Stereo: | ACHIRAL |
| logP: | 2.9167 |
| logD: | 2.9161 |
| logSw: | -3.0276 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 45.831 |
| InChI Key: | KBZZYUXQRFEMAI-UHFFFAOYSA-N |