N-(4-bromophenyl)-N-methyl-3-(2-sulfanylidene-1,3-benzoxazol-3(2H)-yl)propanamide
Chemical Structure Depiction of
N-(4-bromophenyl)-N-methyl-3-(2-sulfanylidene-1,3-benzoxazol-3(2H)-yl)propanamide
N-(4-bromophenyl)-N-methyl-3-(2-sulfanylidene-1,3-benzoxazol-3(2H)-yl)propanamide
Compound characteristics
| Compound ID: | K953-0406 |
| Compound Name: | N-(4-bromophenyl)-N-methyl-3-(2-sulfanylidene-1,3-benzoxazol-3(2H)-yl)propanamide |
| Molecular Weight: | 391.28 |
| Molecular Formula: | C17 H15 Br N2 O2 S |
| Smiles: | CN(C(CCN1C(Oc2ccccc12)=S)=O)c1ccc(cc1)[Br] |
| Stereo: | ACHIRAL |
| logP: | 3.5789 |
| logD: | 3.5789 |
| logSw: | -3.9905 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 24.9664 |
| InChI Key: | DRIUOGCLXPQJJE-UHFFFAOYSA-N |