N-[(2-chlorophenyl)carbamothioyl]-3-(5,5-dimethyl-2-oxooxolan-3-yl)propanamide
Chemical Structure Depiction of
N-[(2-chlorophenyl)carbamothioyl]-3-(5,5-dimethyl-2-oxooxolan-3-yl)propanamide
N-[(2-chlorophenyl)carbamothioyl]-3-(5,5-dimethyl-2-oxooxolan-3-yl)propanamide
Compound characteristics
| Compound ID: | 5664-0423 |
| Compound Name: | N-[(2-chlorophenyl)carbamothioyl]-3-(5,5-dimethyl-2-oxooxolan-3-yl)propanamide |
| Molecular Weight: | 354.85 |
| Molecular Formula: | C16 H19 Cl N2 O3 S |
| Smiles: | CC1(C)CC(CCC(NC(Nc2ccccc2[Cl])=S)=O)C(=O)O1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.818 |
| logD: | 2.8154 |
| logSw: | -3.3139 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 53.135 |
| InChI Key: | VOOHISAXFJDCGE-JTQLQIEISA-N |