benzyl (2,2,2-trichloro-1-{[(naphthalen-1-yl)carbamothioyl]amino}ethyl)carbamate
Chemical Structure Depiction of
benzyl (2,2,2-trichloro-1-{[(naphthalen-1-yl)carbamothioyl]amino}ethyl)carbamate
benzyl (2,2,2-trichloro-1-{[(naphthalen-1-yl)carbamothioyl]amino}ethyl)carbamate
Compound characteristics
| Compound ID: | 0319-0061 |
| Compound Name: | benzyl (2,2,2-trichloro-1-{[(naphthalen-1-yl)carbamothioyl]amino}ethyl)carbamate |
| Molecular Weight: | 482.81 |
| Molecular Formula: | C21 H18 Cl3 N3 O2 S |
| Smiles: | C(c1ccccc1)OC(NC(C([Cl])([Cl])[Cl])NC(Nc1cccc2ccccc12)=S)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.8678 |
| logD: | 5.6608 |
| logSw: | -6.4901 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 50.847 |
| InChI Key: | JHKBUYVEAYWLIT-SFHVURJKSA-N |