N-{[(4-phenyloxan-4-yl)methyl]carbamothioyl}benzamide
Chemical Structure Depiction of
N-{[(4-phenyloxan-4-yl)methyl]carbamothioyl}benzamide
N-{[(4-phenyloxan-4-yl)methyl]carbamothioyl}benzamide
Compound characteristics
| Compound ID: | IB06-1694 |
| Compound Name: | N-{[(4-phenyloxan-4-yl)methyl]carbamothioyl}benzamide |
| Molecular Weight: | 354.47 |
| Molecular Formula: | C20 H22 N2 O2 S |
| Smiles: | C1COCCC1(CNC(NC(c1ccccc1)=O)=S)c1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 3.47 |
| logD: | 3.47 |
| logSw: | -4.18 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 117.53 |
| InChI Key: | IDRFOJIQFUBZKL-UHFFFAOYSA-N |