1-(3-bromophenyl)-2,5-dioxopyrrolidin-3-yl 3,5-diphenyl-4,5-dihydro-1H-pyrazole-1-carboximidothioate
Chemical Structure Depiction of
1-(3-bromophenyl)-2,5-dioxopyrrolidin-3-yl 3,5-diphenyl-4,5-dihydro-1H-pyrazole-1-carboximidothioate
1-(3-bromophenyl)-2,5-dioxopyrrolidin-3-yl 3,5-diphenyl-4,5-dihydro-1H-pyrazole-1-carboximidothioate
Compound characteristics
| Compound ID: | 8008-8669 |
| Compound Name: | 1-(3-bromophenyl)-2,5-dioxopyrrolidin-3-yl 3,5-diphenyl-4,5-dihydro-1H-pyrazole-1-carboximidothioate |
| Molecular Weight: | 533.45 |
| Molecular Formula: | C26 H21 Br N4 O2 S |
| Smiles: | C1C(c2ccccc2)N(C(=N)SC2CC(N(C2=O)c2cccc(c2)[Br])=O)N=C1c1ccccc1 |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 5.1422 |
| logD: | 4.2782 |
| logSw: | -5.4177 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 62.973 |
| InChI Key: | KGKCNYXWWBKXRO-UHFFFAOYSA-N |