2-({2-iodo-6-methoxy-4-[(4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]phenoxy}methyl)benzonitrile
Chemical Structure Depiction of
2-({2-iodo-6-methoxy-4-[(4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]phenoxy}methyl)benzonitrile
2-({2-iodo-6-methoxy-4-[(4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]phenoxy}methyl)benzonitrile
Compound characteristics
| Compound ID: | 3584-1805 |
| Compound Name: | 2-({2-iodo-6-methoxy-4-[(4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]phenoxy}methyl)benzonitrile |
| Molecular Weight: | 508.35 |
| Molecular Formula: | C19 H13 I N2 O3 S2 |
| Smiles: | COc1cc(\C=C2/C(NC(=S)S2)=O)cc(c1OCc1ccccc1C#N)I |
| Stereo: | ACHIRAL |
| logP: | 3.5874 |
| logD: | 2.2362 |
| logSw: | -3.8246 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.988 |
| InChI Key: | VMDDKXWFWGNPGO-UHFFFAOYSA-N |