N-[5-(2-{2-[(5-bromo-2-hydroxyphenyl)methylidene]hydrazinyl}-2-oxoethyl)-1,3,4-thiadiazol-2-yl]butanamide
Chemical Structure Depiction of
N-[5-(2-{2-[(5-bromo-2-hydroxyphenyl)methylidene]hydrazinyl}-2-oxoethyl)-1,3,4-thiadiazol-2-yl]butanamide
N-[5-(2-{2-[(5-bromo-2-hydroxyphenyl)methylidene]hydrazinyl}-2-oxoethyl)-1,3,4-thiadiazol-2-yl]butanamide
Compound characteristics
| Compound ID: | 1067-0471 |
| Compound Name: | N-[5-(2-{2-[(5-bromo-2-hydroxyphenyl)methylidene]hydrazinyl}-2-oxoethyl)-1,3,4-thiadiazol-2-yl]butanamide |
| Molecular Weight: | 426.29 |
| Molecular Formula: | C15 H16 Br N5 O3 S |
| Smiles: | CCCC(Nc1nnc(CC(N/N=C\c2cc(ccc2O)[Br])=O)s1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.0002 |
| logD: | 2.9709 |
| logSw: | -3.1662 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 99.078 |
| InChI Key: | KPUWHFJRBOJADK-UHFFFAOYSA-N |