N'-[(4Z)-3-(4-methoxyphenyl)-3a,7,8,8a-tetrahydro-5,8-epoxyoxepino[4,5-d][1,2]oxazol-4(5H)-ylidene]-2-phenylacetohydrazide
Chemical Structure Depiction of
N'-[(4Z)-3-(4-methoxyphenyl)-3a,7,8,8a-tetrahydro-5,8-epoxyoxepino[4,5-d][1,2]oxazol-4(5H)-ylidene]-2-phenylacetohydrazide
N'-[(4Z)-3-(4-methoxyphenyl)-3a,7,8,8a-tetrahydro-5,8-epoxyoxepino[4,5-d][1,2]oxazol-4(5H)-ylidene]-2-phenylacetohydrazide
Compound characteristics
Compound ID: | 8020-1910 |
Compound Name: | N'-[(4Z)-3-(4-methoxyphenyl)-3a,7,8,8a-tetrahydro-5,8-epoxyoxepino[4,5-d][1,2]oxazol-4(5H)-ylidene]-2-phenylacetohydrazide |
Molecular Weight: | 407.42 |
Molecular Formula: | C22 H21 N3 O5 |
Smiles: | COc1ccc(cc1)C1C2C(C3COC(C/2=N/NC(Cc2ccccc2)=O)O3)ON=1 |
Stereo: | MIXTURE OF STEREOISOMERS |
logP: | 3.2951 |
logD: | 3.2947 |
logSw: | -3.4536 |
Hydrogen bond acceptors count: | 8 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 81.794 |
InChI Key: | VURJCWQVFAALEG-UHFFFAOYSA-N |