2,5-bis[(3,4-diethoxy-5-iodophenyl)methylidene]cyclopentan-1-one
Chemical Structure Depiction of
2,5-bis[(3,4-diethoxy-5-iodophenyl)methylidene]cyclopentan-1-one
2,5-bis[(3,4-diethoxy-5-iodophenyl)methylidene]cyclopentan-1-one
Compound characteristics
Compound ID: | Y509-0380 |
Compound Name: | 2,5-bis[(3,4-diethoxy-5-iodophenyl)methylidene]cyclopentan-1-one |
Molecular Weight: | 688.34 |
Molecular Formula: | C27 H30 I2 O5 |
Smiles: | CCOc1cc(\C=C2/CC/C(=C\c3cc(c(c(c3)I)OCC)OCC)C2=O)cc(c1OCC)I |
Stereo: | ACHIRAL |
logP: | 7.6386 |
logD: | 7.6386 |
logSw: | -5.6534 |
Hydrogen bond acceptors count: | 6 |
Polar surface area: | 42.414 |
InChI Key: | DYQAHUZIWFCDQX-UHFFFAOYSA-N |