5-bromo-1-methyl-3-{4-oxo-3-[(oxolan-2-yl)methyl]-2-sulfanylidene-1,3-thiazolidin-5-ylidene}-1,3-dihydro-2H-indol-2-one
Chemical Structure Depiction of
5-bromo-1-methyl-3-{4-oxo-3-[(oxolan-2-yl)methyl]-2-sulfanylidene-1,3-thiazolidin-5-ylidene}-1,3-dihydro-2H-indol-2-one
5-bromo-1-methyl-3-{4-oxo-3-[(oxolan-2-yl)methyl]-2-sulfanylidene-1,3-thiazolidin-5-ylidene}-1,3-dihydro-2H-indol-2-one
Compound characteristics
| Compound ID: | Y070-0417 |
| Compound Name: | 5-bromo-1-methyl-3-{4-oxo-3-[(oxolan-2-yl)methyl]-2-sulfanylidene-1,3-thiazolidin-5-ylidene}-1,3-dihydro-2H-indol-2-one |
| Molecular Weight: | 439.35 |
| Molecular Formula: | C17 H15 Br N2 O3 S2 |
| Smiles: | CN1C(C(=C2/C(N(CC3CCCO3)C(=S)S2)=O)/c2cc(ccc12)[Br])=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.7923 |
| logD: | 2.7923 |
| logSw: | -3.3424 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 40.603 |
| InChI Key: | HRGHSWQCPLUSCV-SNVBAGLBSA-N |