N-[3-(4-bromophenyl)-1,2,4-thiadiazol-5-yl]-3-(3,4-dimethoxyphenyl)prop-2-enamide
Chemical Structure Depiction of
N-[3-(4-bromophenyl)-1,2,4-thiadiazol-5-yl]-3-(3,4-dimethoxyphenyl)prop-2-enamide
N-[3-(4-bromophenyl)-1,2,4-thiadiazol-5-yl]-3-(3,4-dimethoxyphenyl)prop-2-enamide
Compound characteristics
| Compound ID: | D323-0104 |
| Compound Name: | N-[3-(4-bromophenyl)-1,2,4-thiadiazol-5-yl]-3-(3,4-dimethoxyphenyl)prop-2-enamide |
| Molecular Weight: | 446.32 |
| Molecular Formula: | C19 H16 Br N3 O3 S |
| Smiles: | COc1ccc(/C=C/C(Nc2nc(c3ccc(cc3)[Br])ns2)=O)cc1OC |
| Stereo: | ACHIRAL |
| logP: | 5.3271 |
| logD: | 5.327 |
| logSw: | -5.5344 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 58.965 |
| InChI Key: | YKRAFZJWTFLRQJ-UHFFFAOYSA-N |