1-(4-bromophenyl)-2,5-dioxopyrrolidin-3-yl 2-[(4-hydroxy-3,5-dimethoxyphenyl)methylidene]hydrazine-1-carboximidothioate
Chemical Structure Depiction of
1-(4-bromophenyl)-2,5-dioxopyrrolidin-3-yl 2-[(4-hydroxy-3,5-dimethoxyphenyl)methylidene]hydrazine-1-carboximidothioate
1-(4-bromophenyl)-2,5-dioxopyrrolidin-3-yl 2-[(4-hydroxy-3,5-dimethoxyphenyl)methylidene]hydrazine-1-carboximidothioate
Compound characteristics
| Compound ID: | Y508-1136 |
| Compound Name: | 1-(4-bromophenyl)-2,5-dioxopyrrolidin-3-yl 2-[(4-hydroxy-3,5-dimethoxyphenyl)methylidene]hydrazine-1-carboximidothioate |
| Molecular Weight: | 507.36 |
| Molecular Formula: | C20 H19 Br N4 O5 S |
| Smiles: | COc1cc(/C=N/NC(=N)SC2CC(N(C2=O)c2ccc(cc2)[Br])=O)cc(c1O)OC |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.1998 |
| logD: | 1.0532 |
| logSw: | -2.7898 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 100.585 |
| InChI Key: | IIQRDQCYKSOWLZ-MRXNPFEDSA-N |