N-[(4-bromonaphthalen-1-yl)carbamothioyl]-3-methylbutanamide
Chemical Structure Depiction of
N-[(4-bromonaphthalen-1-yl)carbamothioyl]-3-methylbutanamide
N-[(4-bromonaphthalen-1-yl)carbamothioyl]-3-methylbutanamide
Compound characteristics
| Compound ID: | 8014-0522 |
| Compound Name: | N-[(4-bromonaphthalen-1-yl)carbamothioyl]-3-methylbutanamide |
| Molecular Weight: | 365.29 |
| Molecular Formula: | C16 H17 Br N2 O S |
| Smiles: | CC(C)CC(NC(Nc1ccc(c2ccccc12)[Br])=S)=O |
| Stereo: | ACHIRAL |
| logP: | 4.5241 |
| logD: | 4.5227 |
| logSw: | -4.2027 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 32.328 |
| InChI Key: | CHSJPPPIWPOLIR-UHFFFAOYSA-N |