5-{[3-(3-bromo-4-methoxyphenyl)-1-phenyl-1H-pyrazol-4-yl]methylidene}-3-(prop-2-en-1-yl)-2-sulfanylidene-1,3-thiazolidin-4-one
Chemical Structure Depiction of
5-{[3-(3-bromo-4-methoxyphenyl)-1-phenyl-1H-pyrazol-4-yl]methylidene}-3-(prop-2-en-1-yl)-2-sulfanylidene-1,3-thiazolidin-4-one
5-{[3-(3-bromo-4-methoxyphenyl)-1-phenyl-1H-pyrazol-4-yl]methylidene}-3-(prop-2-en-1-yl)-2-sulfanylidene-1,3-thiazolidin-4-one
Compound characteristics
| Compound ID: | 4476-2994 |
| Compound Name: | 5-{[3-(3-bromo-4-methoxyphenyl)-1-phenyl-1H-pyrazol-4-yl]methylidene}-3-(prop-2-en-1-yl)-2-sulfanylidene-1,3-thiazolidin-4-one |
| Molecular Weight: | 512.45 |
| Molecular Formula: | C23 H18 Br N3 O2 S2 |
| Smiles: | COc1ccc(cc1[Br])c1c(/C=C2/C(N(CC=C)C(=S)S2)=O)cn(c2ccccc2)n1 |
| Stereo: | ACHIRAL |
| logP: | 5.6135 |
| logD: | 5.6135 |
| logSw: | -5.3797 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 38.955 |
| InChI Key: | TVHDZAKDCXIIMB-UHFFFAOYSA-N |