N~2~-{benzyl[(pyridin-3-yl)methyl]carbamothioyl}-N-butylglycinamide
Chemical Structure Depiction of
N~2~-{benzyl[(pyridin-3-yl)methyl]carbamothioyl}-N-butylglycinamide
N~2~-{benzyl[(pyridin-3-yl)methyl]carbamothioyl}-N-butylglycinamide
Compound characteristics
| Compound ID: | K784-4037 |
| Compound Name: | N~2~-{benzyl[(pyridin-3-yl)methyl]carbamothioyl}-N-butylglycinamide |
| Molecular Weight: | 370.52 |
| Molecular Formula: | C20 H26 N4 O S |
| Smiles: | CCCCNC(CNC(N(Cc1ccccc1)Cc1cccnc1)=S)=O |
| Stereo: | ACHIRAL |
| logP: | 2.7723 |
| logD: | 2.7716 |
| logSw: | -2.8657 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 45.852 |
| InChI Key: | KAOWVZGEJQYQTO-UHFFFAOYSA-N |