N-[(4-bromophenyl)carbamothioyl]-3-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)propanamide
Chemical Structure Depiction of
N-[(4-bromophenyl)carbamothioyl]-3-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)propanamide
N-[(4-bromophenyl)carbamothioyl]-3-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)propanamide
Compound characteristics
| Compound ID: | 1683-6253 |
| Compound Name: | N-[(4-bromophenyl)carbamothioyl]-3-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)propanamide |
| Molecular Weight: | 432.29 |
| Molecular Formula: | C18 H14 Br N3 O3 S |
| Smiles: | C(CN1C(c2ccccc2C1=O)=O)C(NC(Nc1ccc(cc1)[Br])=S)=O |
| Stereo: | ACHIRAL |
| logP: | 3.1606 |
| logD: | 3.1585 |
| logSw: | -3.6864 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 62.529 |
| InChI Key: | YHHDBZSGPGAHKH-UHFFFAOYSA-N |