2-{3-[(4-bromophenoxy)methyl]benzoyl}-N-(2,4-dimethoxyphenyl)hydrazine-1-carbothioamide
Chemical Structure Depiction of
2-{3-[(4-bromophenoxy)methyl]benzoyl}-N-(2,4-dimethoxyphenyl)hydrazine-1-carbothioamide
2-{3-[(4-bromophenoxy)methyl]benzoyl}-N-(2,4-dimethoxyphenyl)hydrazine-1-carbothioamide
Compound characteristics
| Compound ID: | Y502-5748 |
| Compound Name: | 2-{3-[(4-bromophenoxy)methyl]benzoyl}-N-(2,4-dimethoxyphenyl)hydrazine-1-carbothioamide |
| Molecular Weight: | 516.41 |
| Molecular Formula: | C23 H22 Br N3 O4 S |
| Smiles: | COc1ccc(c(c1)OC)NC(NNC(c1cccc(COc2ccc(cc2)[Br])c1)=O)=S |
| Stereo: | ACHIRAL |
| logP: | 5.0464 |
| logD: | 4.8575 |
| logSw: | -4.8717 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 68.87 |
| InChI Key: | DCYXCVPFSGMCGC-UHFFFAOYSA-N |