5-{[3-(3-oxo-3H-naphtho[2,1-b]pyran-2-yl)-1-phenyl-1H-pyrazol-4-yl]methylidene}-3-phenyl-2-sulfanylideneimidazolidin-4-one
Chemical Structure Depiction of
5-{[3-(3-oxo-3H-naphtho[2,1-b]pyran-2-yl)-1-phenyl-1H-pyrazol-4-yl]methylidene}-3-phenyl-2-sulfanylideneimidazolidin-4-one
5-{[3-(3-oxo-3H-naphtho[2,1-b]pyran-2-yl)-1-phenyl-1H-pyrazol-4-yl]methylidene}-3-phenyl-2-sulfanylideneimidazolidin-4-one
Compound characteristics
| Compound ID: | 3957-1096 |
| Compound Name: | 5-{[3-(3-oxo-3H-naphtho[2,1-b]pyran-2-yl)-1-phenyl-1H-pyrazol-4-yl]methylidene}-3-phenyl-2-sulfanylideneimidazolidin-4-one |
| Molecular Weight: | 540.6 |
| Molecular Formula: | C32 H20 N4 O3 S |
| Smiles: | C1=C(C(=O)Oc2ccc3ccccc3c12)c1c(\C=C2/C(N(C(N2)=S)c2ccccc2)=O)cn(c2ccccc2)n1 |
| Stereo: | ACHIRAL |
| logP: | 5.6048 |
| logD: | 5.4563 |
| logSw: | -7.0138 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 62.179 |
| InChI Key: | OYUDEIMBLPTTOA-UHFFFAOYSA-N |