3-[3-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene]-1-propyl-1,3-dihydro-2H-indol-2-one
Chemical Structure Depiction of
3-[3-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene]-1-propyl-1,3-dihydro-2H-indol-2-one
3-[3-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene]-1-propyl-1,3-dihydro-2H-indol-2-one
Compound characteristics
| Compound ID: | 3531-5315 |
| Compound Name: | 3-[3-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene]-1-propyl-1,3-dihydro-2H-indol-2-one |
| Molecular Weight: | 490.6 |
| Molecular Formula: | C25 H22 N4 O3 S2 |
| Smiles: | CCCN1C(C(=C2/C(N(C3=C(C)N(C)N(C3=O)c3ccccc3)C(=S)S2)=O)/c2ccccc12)=O |
| Stereo: | ACHIRAL |
| logP: | 3.1546 |
| logD: | 3.1546 |
| logSw: | -3.5981 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 51.65 |
| InChI Key: | QNLLNRAYAZOBMQ-VZCXRCSSSA-N |