(9E)-9-[[3-ethoxy-4-(4-ethylimidazol-1-yl)phenyl]methylidene]-4-(4-fluorophenyl)spiro[3,4,6,8-tetrahydropyrido[2,1-c][1,2,4]oxadiazine-7,1'-cyclopropane];(9E)-4-(4-fluorophenyl)-9-[[3-methoxy-4-(4-methylimidazol-1-yl)phenyl]methylidene]spiro[3,4,6,8-tetrahydropyrido[2,1-c][1,2,4]oxadiazine-7,1'-cyclopropane];(9E)-4-(4-fluorophenyl)-9-[[5-(4-methylimidazol-1-yl)-2-bicyclo[4.2.0]octa-1,3,5-trienyl]methylidene]spiro[3,4,6,8-tetrahydropyrido[2,1-c][1,2,4]oxadiazine-7,3'-oxetane];(9E)-4-(4-fluorophenyl)-3-methyl-9-[[7-(4-methylimidazol-1-yl)-1,2-benzothiazol-4-yl]methylidene]spiro[3,4,6,8-tetrahydropyrido[2,1-c][1,2,4]oxadiazine-7,3'-oxetane];(9E)-4-(4-fluorophenyl)-3-methyl-9-[[7-(4-methylimidazol-1-yl)-1,2-benzoxazol-4-yl]methylidene]spiro[3,4,6,8-tetrahydropyrido[2,1-c][1,2,4]oxadiazine-7,3'-oxetane];(9E)-4-(4-fluorophenyl)-9-[[3-methyl-7-(4-methylimidazol-1-yl)-1,2-benzoxazol-4-yl]methylidene]spiro[3,4,6,8-tetrahydropyrido[2,1-c][1,2,4]oxadiazine-7,3'-oxetane]

C168H163F6N27O14S — CID 160688561

About (9E)-9-[[3-ethoxy-4-(4-ethylimidazol-1-yl)phenyl]methylidene]-4-(4-fluorophenyl)spiro[3,4,6,8-tetrahydropyrido[2,1-c][1,2,4]oxadiazine-7,1'-cyclopropane];(9E)-4-(4-fluorophenyl)-9-[[3-methoxy-4-(4-methylimidazol-1-yl)phenyl]methylidene]spiro[3,4,6,8-tetrahydropyrido[2,1-c][1,2,4]oxadiazine-7,1'-cyclopropane];(9E)-4-(4-fluorophenyl)-9-[[5-(4-methylimidazol-1-yl)-2-bicyclo[4.2.0]octa-1,3,5-trienyl]methylidene]spiro[3,4,6,8-tetrahydropyrido[2,1-c][1,2,4]oxadiazine-7,3'-oxetane];(9E)-4-(4-fluorophenyl)-3-methyl-9-[[7-(4-methylimidazol-1-yl)-1,2-benzothiazol-4-yl]methylidene]spiro[3,4,6,8-tetrahydropyrido[2,1-c][1,2,4]oxadiazine-7,3'-oxetane];(9E)-4-(4-fluorophenyl)-3-methyl-9-[[7-(4-methylimidazol-1-yl)-1,2-benzoxazol-4-yl]methylidene]spiro[3,4,6,8-tetrahydropyrido[2,1-c][1,2,4]oxadiazine-7,3'-oxetane];(9E)-4-(4-fluorophenyl)-9-[[3-methyl-7-(4-methylimidazol-1-yl)-1,2-benzoxazol-4-yl]methylidene]spiro[3,4,6,8-tetrahydropyrido[2,1-c][1,2,4]oxadiazine-7,3'-oxetane]

(9E)-9-[[3-ethoxy-4-(4-ethylimidazol-1-yl)phenyl]methylidene]-4-(4-fluorophenyl)spiro[3,4,6,8-tetrahydropyrido[2,1-c][1,2,4]oxadiazine-7,1'-cyclopropane];(9E)-4-(4-fluorophenyl)-9-[[3-methoxy-4-(4-methylimidazol-1-yl)phenyl]methylidene]spiro[3,4,6,8-tetrahydropyrido[2,1-c][1,2,4]oxadiazine-7,1'-cyclopropane];(9E)-4-(4-fluorophenyl)-9-[[5-(4-methylimidazol-1-yl)-2-bicyclo[4.2.0]octa-1,3,5-trienyl]methylidene]spiro[3,4,6,8-tetrahydropyrido[2,1-c][1,2,4]oxadiazine-7,3'-oxetane];(9E)-4-(4-fluorophenyl)-3-methyl-9-[[7-(4-methylimidazol-1-yl)-1,2-benzothiazol-4-yl]methylidene]spiro[3,4,6,8-tetrahydropyrido[2,1-c][1,2,4]oxadiazine-7,3'-oxetane];(9E)-4-(4-fluorophenyl)-3-methyl-9-[[7-(4-methylimidazol-1-yl)-1,2-benzoxazol-4-yl]methylidene]spiro[3,4,6,8-tetrahydropyrido[2,1-c][1,2,4]oxadiazine-7,3'-oxetane];(9E)-4-(4-fluorophenyl)-9-[[3-methyl-7-(4-methylimidazol-1-yl)-1,2-benzoxazol-4-yl]methylidene]spiro[3,4,6,8-tetrahydropyrido[2,1-c][1,2,4]oxadiazine-7,3'-oxetane] (PubChem CID 160688561) has the molecular formula C168H163F6N27O14S and a molecular weight of 2930.38 g/mol. Its IUPAC name is (9E)-9-[[3-ethoxy-4-(4-ethylimidazol-1-yl)phenyl]methylidene]-4-(4-fluorophenyl)spiro[3,4,6,8-tetrahydropyrido[2,1-c][1,2,4]oxadiazine-7,1'-cyclopropane];(9E)-4-(4-fluorophenyl)-9-[[3-methoxy-4-(4-methylimidazol-1-yl)phenyl]methylidene]spiro[3,4,6,8-tetrahydropyrido[2,1-c][1,2,4]oxadiazine-7,1'-cyclopropane];(9E)-4-(4-fluorophenyl)-9-[[5-(4-methylimidazol-1-yl)-2-bicyclo[4.2.0]octa-1,3,5-trienyl]methylidene]spiro[3,4,6,8-tetrahydropyrido[2,1-c][1,2,4]oxadiazine-7,3'-oxetane];(9E)-4-(4-fluorophenyl)-3-methyl-9-[[7-(4-methylimidazol-1-yl)-1,2-benzothiazol-4-yl]methylidene]spiro[3,4,6,8-tetrahydropyrido[2,1-c][1,2,4]oxadiazine-7,3'-oxetane];(9E)-4-(4-fluorophenyl)-3-methyl-9-[[7-(4-methylimidazol-1-yl)-1,2-benzoxazol-4-yl]methylidene]spiro[3,4,6,8-tetrahydropyrido[2,1-c][1,2,4]oxadiazine-7,3'-oxetane];(9E)-4-(4-fluorophenyl)-9-[[3-methyl-7-(4-methylimidazol-1-yl)-1,2-benzoxazol-4-yl]methylidene]spiro[3,4,6,8-tetrahydropyrido[2,1-c][1,2,4]oxadiazine-7,3'-oxetane].

Molecular Properties

• Compound Name: (9E)-9-[[3-ethoxy-4-(4-ethylimidazol-1-yl)phenyl]methylidene]-4-(4-fluorophenyl)spiro[3,4,6,8-tetrahydropyrido[2,1-c][1,2,4]oxadiazine-7,1'-cyclopropane];(9E)-4-(4-fluorophenyl)-9-[[3-methoxy-4-(4-methylimidazol-1-yl)phenyl]methylidene]spiro[3,4,6,8-tetrahydropyrido[2,1-c][1,2,4]oxadiazine-7,1'-cyclopropane];(9E)-4-(4-fluorophenyl)-9-[[5-(4-methylimidazol-1-yl)-2-bicyclo[4.2.0]octa-1,3,5-trienyl]methylidene]spiro[3,4,6,8-tetrahydropyrido[2,1-c][1,2,4]oxadiazine-7,3'-oxetane];(9E)-4-(4-fluorophenyl)-3-methyl-9-[[7-(4-methylimidazol-1-yl)-1,2-benzothiazol-4-yl]methylidene]spiro[3,4,6,8-tetrahydropyrido[2,1-c][1,2,4]oxadiazine-7,3'-oxetane];(9E)-4-(4-fluorophenyl)-3-methyl-9-[[7-(4-methylimidazol-1-yl)-1,2-benzoxazol-4-yl]methylidene]spiro[3,4,6,8-tetrahydropyrido[2,1-c][1,2,4]oxadiazine-7,3'-oxetane];(9E)-4-(4-fluorophenyl)-9-[[3-methyl-7-(4-methylimidazol-1-yl)-1,2-benzoxazol-4-yl]methylidene]spiro[3,4,6,8-tetrahydropyrido[2,1-c][1,2,4]oxadiazine-7,3'-oxetane]
• PubChem CID: 160688561
• Molecular Formula: C168H163F6N27O14S
• Molecular Weight: 2930.38 g/mol
• Exact Mass: 2928.25
• IUPAC Name: (9E)-9-[[3-ethoxy-4-(4-ethylimidazol-1-yl)phenyl]methylidene]-4-(4-fluorophenyl)spiro[3,4,6,8-tetrahydropyrido[2,1-c][1,2,4]oxadiazine-7,1'-cyclopropane];(9E)-4-(4-fluorophenyl)-9-[[3-methoxy-4-(4-methylimidazol-1-yl)phenyl]methylidene]spiro[3,4,6,8-tetrahydropyrido[2,1-c][1,2,4]oxadiazine-7,1'-cyclopropane];(9E)-4-(4-fluorophenyl)-9-[[5-(4-methylimidazol-1-yl)-2-bicyclo[4.2.0]octa-1,3,5-trienyl]methylidene]spiro[3,4,6,8-tetrahydropyrido[2,1-c][1,2,4]oxadiazine-7,3'-oxetane];(9E)-4-(4-fluorophenyl)-3-methyl-9-[[7-(4-methylimidazol-1-yl)-1,2-benzothiazol-4-yl]methylidene]spiro[3,4,6,8-tetrahydropyrido[2,1-c][1,2,4]oxadiazine-7,3'-oxetane];(9E)-4-(4-fluorophenyl)-3-methyl-9-[[7-(4-methylimidazol-1-yl)-1,2-benzoxazol-4-yl]methylidene]spiro[3,4,6,8-tetrahydropyrido[2,1-c][1,2,4]oxadiazine-7,3'-oxetane];(9E)-4-(4-fluorophenyl)-9-[[3-methyl-7-(4-methylimidazol-1-yl)-1,2-benzoxazol-4-yl]methylidene]spiro[3,4,6,8-tetrahydropyrido[2,1-c][1,2,4]oxadiazine-7,3'-oxetane]
• SMILES: CCOc1cc(/C=C2\CC3(CC3)CN3C2=NOCC3c2ccc(F)cc2)ccc1-n1cnc(CC)c1.COc1cc(/C=C2\CC3(CC3)CN3C2=NOCC3c2ccc(F)cc2)ccc1-n1cnc(C)c1.Cc1cn(-c2ccc(/C=C3\CC4(COC4)CN4C3=NOC(C)C4c3ccc(F)cc3)c3cnoc23)cn1.Cc1cn(-c2ccc(/C=C3\CC4(COC4)CN4C3=NOC(C)C4c3ccc(F)cc3)c3cnsc23)cn1.Cc1cn(-c2ccc(/C=C3\CC4(COC4)CN4C3=NOCC4c3ccc(F)cc3)c3c(C)noc23)cn1.Cc1cn(-c2ccc(/C=C3\CC4(COC4)CN4C3=NOCC4c3ccc(F)cc3)c3c2CC3)cn1
• InChI: InChI=1S/C29H31FN4O2.2C28H26FN5O3.C28H26FN5O2S.C28H27FN4O2.C27H27FN4O2/c1-3-24-16-33(19-31-24)25-10-5-20(14-27(25)35-4-2)13-22-15-29(11-12-29)18-34-26(17-36-32-28(22)34)21-6-8-23(30)9-7-21;1-17-12-33(16-30-17)24-8-5-20(23-11-31-37-26(23)24)9-21-10-28(14-35-15-28)13-34-25(18(2)36-32-27(21)34)19-3-6-22(29)7-4-19;1-17-11-33(16-30-17)23-8-5-20(25-18(2)31-37-26(23)25)9-21-10-28(14-35-15-28)13-34-24(12-36-32-27(21)34)19-3-6-22(29)7-4-19;1-17-12-33(16-30-17)24-8-5-20(23-11-31-37-26(23)24)9-21-10-28(14-35-15-28)13-34-25(18(2)36-32-27(21)34)19-3-6-22(29)7-4-19;1-18-12-32(17-30-18)25-9-4-20(23-7-8-24(23)25)10-21-11-28(15-34-16-28)14-33-26(13-35-31-27(21)33)19-2-5-22(29)6-3-19;1-18-14-31(17-29-18)23-8-3-19(12-25(23)33-2)11-21-13-27(9-10-27)16-32-24(15-34-30-26(21)32)20-4-6-22(28)7-5-20/h5-10,13-14,16,19,26H,3-4,11-12,15,17-18H2,1-2H3;3-9,11-12,16,18,25H,10,13-15H2,1-2H3;3-9,11,16,24H,10,12-15H2,1-2H3;3-9,11-12,16,18,25H,10,13-15H2,1-2H3;2-6,9-10,12,17,26H,7-8,11,13-16H2,1H3;3-8,11-12,14,17,24H,9-10,13,15-16H2,1-2H3/b22-13+;3*21-9+;21-10+;21-11+
• InChIKey: RPCIIKRNQQIZDM-MFXMSRQDSA-N
• XLogP: 31.33
• TPSA: 376.23 Ų
• H-Bond Acceptors: 42
• Rotatable Bonds: 22
• Heavy Atoms: 216
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2930.38
LogP ≤ 5	31.33
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	42

Frequently Asked Questions

What is the IUPAC name of (9E)-9-[[3-ethoxy-4-(4-ethylimidazol-1-yl)phenyl]methylidene]-4-(4-fluorophenyl)spiro[3,4,6,8-tetrahydropyrido[2,1-c][1,2,4]oxadiazine-7,1'-cyclopropane];(9E)-4-(4-fluorophenyl)-9-[[3-methoxy-4-(4-methylimidazol-1-yl)phenyl]methylidene]spiro[3,4,6,8-tetrahydropyrido[2,1-c][1,2,4]oxadiazine-7,1'-cyclopropane];(9E)-4-(4-fluorophenyl)-9-[[5-(4-methylimidazol-1-yl)-2-bicyclo[4.2.0]octa-1,3,5-trienyl]methylidene]spiro[3,4,6,8-tetrahydropyrido[2,1-c][1,2,4]oxadiazine-7,3'-oxetane];(9E)-4-(4-fluorophenyl)-3-methyl-9-[[7-(4-methylimidazol-1-yl)-1,2-benzothiazol-4-yl]methylidene]spiro[3,4,6,8-tetrahydropyrido[2,1-c][1,2,4]oxadiazine-7,3'-oxetane];(9E)-4-(4-fluorophenyl)-3-methyl-9-[[7-(4-methylimidazol-1-yl)-1,2-benzoxazol-4-yl]methylidene]spiro[3,4,6,8-tetrahydropyrido[2,1-c][1,2,4]oxadiazine-7,3'-oxetane];(9E)-4-(4-fluorophenyl)-9-[[3-methyl-7-(4-methylimidazol-1-yl)-1,2-benzoxazol-4-yl]methylidene]spiro[3,4,6,8-tetrahydropyrido[2,1-c][1,2,4]oxadiazine-7,3'-oxetane]?

The IUPAC name of (9E)-9-[[3-ethoxy-4-(4-ethylimidazol-1-yl)phenyl]methylidene]-4-(4-fluorophenyl)spiro[3,4,6,8-tetrahydropyrido[2,1-c][1,2,4]oxadiazine-7,1'-cyclopropane];(9E)-4-(4-fluorophenyl)-9-[[3-methoxy-4-(4-methylimidazol-1-yl)phenyl]methylidene]spiro[3,4,6,8-tetrahydropyrido[2,1-c][1,2,4]oxadiazine-7,1'-cyclopropane];(9E)-4-(4-fluorophenyl)-9-[[5-(4-methylimidazol-1-yl)-2-bicyclo[4.2.0]octa-1,3,5-trienyl]methylidene]spiro[3,4,6,8-tetrahydropyrido[2,1-c][1,2,4]oxadiazine-7,3'-oxetane];(9E)-4-(4-fluorophenyl)-3-methyl-9-[[7-(4-methylimidazol-1-yl)-1,2-benzothiazol-4-yl]methylidene]spiro[3,4,6,8-tetrahydropyrido[2,1-c][1,2,4]oxadiazine-7,3'-oxetane];(9E)-4-(4-fluorophenyl)-3-methyl-9-[[7-(4-methylimidazol-1-yl)-1,2-benzoxazol-4-yl]methylidene]spiro[3,4,6,8-tetrahydropyrido[2,1-c][1,2,4]oxadiazine-7,3'-oxetane];(9E)-4-(4-fluorophenyl)-9-[[3-methyl-7-(4-methylimidazol-1-yl)-1,2-benzoxazol-4-yl]methylidene]spiro[3,4,6,8-tetrahydropyrido[2,1-c][1,2,4]oxadiazine-7,3'-oxetane] (CID 160688561) is (9E)-9-[[3-ethoxy-4-(4-ethylimidazol-1-yl)phenyl]methylidene]-4-(4-fluorophenyl)spiro[3,4,6,8-tetrahydropyrido[2,1-c][1,2,4]oxadiazine-7,1'-cyclopropane];(9E)-4-(4-fluorophenyl)-9-[[3-methoxy-4-(4-methylimidazol-1-yl)phenyl]methylidene]spiro[3,4,6,8-tetrahydropyrido[2,1-c][1,2,4]oxadiazine-7,1'-cyclopropane];(9E)-4-(4-fluorophenyl)-9-[[5-(4-methylimidazol-1-yl)-2-bicyclo[4.2.0]octa-1,3,5-trienyl]methylidene]spiro[3,4,6,8-tetrahydropyrido[2,1-c][1,2,4]oxadiazine-7,3'-oxetane];(9E)-4-(4-fluorophenyl)-3-methyl-9-[[7-(4-methylimidazol-1-yl)-1,2-benzothiazol-4-yl]methylidene]spiro[3,4,6,8-tetrahydropyrido[2,1-c][1,2,4]oxadiazine-7,3'-oxetane];(9E)-4-(4-fluorophenyl)-3-methyl-9-[[7-(4-methylimidazol-1-yl)-1,2-benzoxazol-4-yl]methylidene]spiro[3,4,6,8-tetrahydropyrido[2,1-c][1,2,4]oxadiazine-7,3'-oxetane];(9E)-4-(4-fluorophenyl)-9-[[3-methyl-7-(4-methylimidazol-1-yl)-1,2-benzoxazol-4-yl]methylidene]spiro[3,4,6,8-tetrahydropyrido[2,1-c][1,2,4]oxadiazine-7,3'-oxetane].

What is the SMILES notation for (9E)-9-[[3-ethoxy-4-(4-ethylimidazol-1-yl)phenyl]methylidene]-4-(4-fluorophenyl)spiro[3,4,6,8-tetrahydropyrido[2,1-c][1,2,4]oxadiazine-7,1'-cyclopropane];(9E)-4-(4-fluorophenyl)-9-[[3-methoxy-4-(4-methylimidazol-1-yl)phenyl]methylidene]spiro[3,4,6,8-tetrahydropyrido[2,1-c][1,2,4]oxadiazine-7,1'-cyclopropane];(9E)-4-(4-fluorophenyl)-9-[[5-(4-methylimidazol-1-yl)-2-bicyclo[4.2.0]octa-1,3,5-trienyl]methylidene]spiro[3,4,6,8-tetrahydropyrido[2,1-c][1,2,4]oxadiazine-7,3'-oxetane];(9E)-4-(4-fluorophenyl)-3-methyl-9-[[7-(4-methylimidazol-1-yl)-1,2-benzothiazol-4-yl]methylidene]spiro[3,4,6,8-tetrahydropyrido[2,1-c][1,2,4]oxadiazine-7,3'-oxetane];(9E)-4-(4-fluorophenyl)-3-methyl-9-[[7-(4-methylimidazol-1-yl)-1,2-benzoxazol-4-yl]methylidene]spiro[3,4,6,8-tetrahydropyrido[2,1-c][1,2,4]oxadiazine-7,3'-oxetane];(9E)-4-(4-fluorophenyl)-9-[[3-methyl-7-(4-methylimidazol-1-yl)-1,2-benzoxazol-4-yl]methylidene]spiro[3,4,6,8-tetrahydropyrido[2,1-c][1,2,4]oxadiazine-7,3'-oxetane]?

The canonical SMILES for (9E)-9-[[3-ethoxy-4-(4-ethylimidazol-1-yl)phenyl]methylidene]-4-(4-fluorophenyl)spiro[3,4,6,8-tetrahydropyrido[2,1-c][1,2,4]oxadiazine-7,1'-cyclopropane];(9E)-4-(4-fluorophenyl)-9-[[3-methoxy-4-(4-methylimidazol-1-yl)phenyl]methylidene]spiro[3,4,6,8-tetrahydropyrido[2,1-c][1,2,4]oxadiazine-7,1'-cyclopropane];(9E)-4-(4-fluorophenyl)-9-[[5-(4-methylimidazol-1-yl)-2-bicyclo[4.2.0]octa-1,3,5-trienyl]methylidene]spiro[3,4,6,8-tetrahydropyrido[2,1-c][1,2,4]oxadiazine-7,3'-oxetane];(9E)-4-(4-fluorophenyl)-3-methyl-9-[[7-(4-methylimidazol-1-yl)-1,2-benzothiazol-4-yl]methylidene]spiro[3,4,6,8-tetrahydropyrido[2,1-c][1,2,4]oxadiazine-7,3'-oxetane];(9E)-4-(4-fluorophenyl)-3-methyl-9-[[7-(4-methylimidazol-1-yl)-1,2-benzoxazol-4-yl]methylidene]spiro[3,4,6,8-tetrahydropyrido[2,1-c][1,2,4]oxadiazine-7,3'-oxetane];(9E)-4-(4-fluorophenyl)-9-[[3-methyl-7-(4-methylimidazol-1-yl)-1,2-benzoxazol-4-yl]methylidene]spiro[3,4,6,8-tetrahydropyrido[2,1-c][1,2,4]oxadiazine-7,3'-oxetane] is CCOc1cc(/C=C2\CC3(CC3)CN3C2=NOCC3c2ccc(F)cc2)ccc1-n1cnc(CC)c1.COc1cc(/C=C2\CC3(CC3)CN3C2=NOCC3c2ccc(F)cc2)ccc1-n1cnc(C)c1.Cc1cn(-c2ccc(/C=C3\CC4(COC4)CN4C3=NOC(C)C4c3ccc(F)cc3)c3cnoc23)cn1.Cc1cn(-c2ccc(/C=C3\CC4(COC4)CN4C3=NOC(C)C4c3ccc(F)cc3)c3cnsc23)cn1.Cc1cn(-c2ccc(/C=C3\CC4(COC4)CN4C3=NOCC4c3ccc(F)cc3)c3c(C)noc23)cn1.Cc1cn(-c2ccc(/C=C3\CC4(COC4)CN4C3=NOCC4c3ccc(F)cc3)c3c2CC3)cn1.

What is the InChIKey of (9E)-9-[[3-ethoxy-4-(4-ethylimidazol-1-yl)phenyl]methylidene]-4-(4-fluorophenyl)spiro[3,4,6,8-tetrahydropyrido[2,1-c][1,2,4]oxadiazine-7,1'-cyclopropane];(9E)-4-(4-fluorophenyl)-9-[[3-methoxy-4-(4-methylimidazol-1-yl)phenyl]methylidene]spiro[3,4,6,8-tetrahydropyrido[2,1-c][1,2,4]oxadiazine-7,1'-cyclopropane];(9E)-4-(4-fluorophenyl)-9-[[5-(4-methylimidazol-1-yl)-2-bicyclo[4.2.0]octa-1,3,5-trienyl]methylidene]spiro[3,4,6,8-tetrahydropyrido[2,1-c][1,2,4]oxadiazine-7,3'-oxetane];(9E)-4-(4-fluorophenyl)-3-methyl-9-[[7-(4-methylimidazol-1-yl)-1,2-benzothiazol-4-yl]methylidene]spiro[3,4,6,8-tetrahydropyrido[2,1-c][1,2,4]oxadiazine-7,3'-oxetane];(9E)-4-(4-fluorophenyl)-3-methyl-9-[[7-(4-methylimidazol-1-yl)-1,2-benzoxazol-4-yl]methylidene]spiro[3,4,6,8-tetrahydropyrido[2,1-c][1,2,4]oxadiazine-7,3'-oxetane];(9E)-4-(4-fluorophenyl)-9-[[3-methyl-7-(4-methylimidazol-1-yl)-1,2-benzoxazol-4-yl]methylidene]spiro[3,4,6,8-tetrahydropyrido[2,1-c][1,2,4]oxadiazine-7,3'-oxetane]?

The InChIKey is RPCIIKRNQQIZDM-MFXMSRQDSA-N. The full InChI is InChI=1S/C29H31FN4O2.2C28H26FN5O3.C28H26FN5O2S.C28H27FN4O2.C27H27FN4O2/c1-3-24-16-33(19-31-24)25-10-5-20(14-27(25)35-4-2)13-22-15-29(11-12-29)18-34-26(17-36-32-28(22)34)21-6-8-23(30)9-7-21;1-17-12-33(16-30-17)24-8-5-20(23-11-31-37-26(23)24)9-21-10-28(14-35-15-28)13-34-25(18(2)36-32-27(21)34)19-3-6-22(29)7-4-19;1-17-11-33(16-30-17)23-8-5-20(25-18(2)31-37-26(23)25)9-21-10-28(14-35-15-28)13-34-24(12-36-32-27(21)34)19-3-6-22(29)7-4-19;1-17-12-33(16-30-17)24-8-5-20(23-11-31-37-26(23)24)9-21-10-28(14-35-15-28)13-34-25(18(2)36-32-27(21)34)19-3-6-22(29)7-4-19;1-18-12-32(17-30-18)25-9-4-20(23-7-8-24(23)25)10-21-11-28(15-34-16-28)14-33-26(13-35-31-27(21)33)19-2-5-22(29)6-3-19;1-18-14-31(17-29-18)23-8-3-19(12-25(23)33-2)11-21-13-27(9-10-27)16-32-24(15-34-30-26(21)32)20-4-6-22(28)7-5-20/h5-10,13-14,16,19,26H,3-4,11-12,15,17-18H2,1-2H3;3-9,11-12,16,18,25H,10,13-15H2,1-2H3;3-9,11,16,24H,10,12-15H2,1-2H3;3-9,11-12,16,18,25H,10,13-15H2,1-2H3;2-6,9-10,12,17,26H,7-8,11,13-16H2,1H3;3-8,11-12,14,17,24H,9-10,13,15-16H2,1-2H3/b22-13+;3*21-9+;21-10+;21-11+.

What are the key properties of (9E)-9-[[3-ethoxy-4-(4-ethylimidazol-1-yl)phenyl]methylidene]-4-(4-fluorophenyl)spiro[3,4,6,8-tetrahydropyrido[2,1-c][1,2,4]oxadiazine-7,1'-cyclopropane];(9E)-4-(4-fluorophenyl)-9-[[3-methoxy-4-(4-methylimidazol-1-yl)phenyl]methylidene]spiro[3,4,6,8-tetrahydropyrido[2,1-c][1,2,4]oxadiazine-7,1'-cyclopropane];(9E)-4-(4-fluorophenyl)-9-[[5-(4-methylimidazol-1-yl)-2-bicyclo[4.2.0]octa-1,3,5-trienyl]methylidene]spiro[3,4,6,8-tetrahydropyrido[2,1-c][1,2,4]oxadiazine-7,3'-oxetane];(9E)-4-(4-fluorophenyl)-3-methyl-9-[[7-(4-methylimidazol-1-yl)-1,2-benzothiazol-4-yl]methylidene]spiro[3,4,6,8-tetrahydropyrido[2,1-c][1,2,4]oxadiazine-7,3'-oxetane];(9E)-4-(4-fluorophenyl)-3-methyl-9-[[7-(4-methylimidazol-1-yl)-1,2-benzoxazol-4-yl]methylidene]spiro[3,4,6,8-tetrahydropyrido[2,1-c][1,2,4]oxadiazine-7,3'-oxetane];(9E)-4-(4-fluorophenyl)-9-[[3-methyl-7-(4-methylimidazol-1-yl)-1,2-benzoxazol-4-yl]methylidene]spiro[3,4,6,8-tetrahydropyrido[2,1-c][1,2,4]oxadiazine-7,3'-oxetane]?

(9E)-9-[[3-ethoxy-4-(4-ethylimidazol-1-yl)phenyl]methylidene]-4-(4-fluorophenyl)spiro[3,4,6,8-tetrahydropyrido[2,1-c][1,2,4]oxadiazine-7,1'-cyclopropane];(9E)-4-(4-fluorophenyl)-9-[[3-methoxy-4-(4-methylimidazol-1-yl)phenyl]methylidene]spiro[3,4,6,8-tetrahydropyrido[2,1-c][1,2,4]oxadiazine-7,1'-cyclopropane];(9E)-4-(4-fluorophenyl)-9-[[5-(4-methylimidazol-1-yl)-2-bicyclo[4.2.0]octa-1,3,5-trienyl]methylidene]spiro[3,4,6,8-tetrahydropyrido[2,1-c][1,2,4]oxadiazine-7,3'-oxetane];(9E)-4-(4-fluorophenyl)-3-methyl-9-[[7-(4-methylimidazol-1-yl)-1,2-benzothiazol-4-yl]methylidene]spiro[3,4,6,8-tetrahydropyrido[2,1-c][1,2,4]oxadiazine-7,3'-oxetane];(9E)-4-(4-fluorophenyl)-3-methyl-9-[[7-(4-methylimidazol-1-yl)-1,2-benzoxazol-4-yl]methylidene]spiro[3,4,6,8-tetrahydropyrido[2,1-c][1,2,4]oxadiazine-7,3'-oxetane];(9E)-4-(4-fluorophenyl)-9-[[3-methyl-7-(4-methylimidazol-1-yl)-1,2-benzoxazol-4-yl]methylidene]spiro[3,4,6,8-tetrahydropyrido[2,1-c][1,2,4]oxadiazine-7,3'-oxetane] has a molecular weight of 2930.38 g/mol, XLogP of 31.33, 22 rotatable bonds, 0 hydrogen bond donors, and 42 hydrogen bond acceptors.

Where does this data come from?

All data for (9E)-9-[[3-ethoxy-4-(4-ethylimidazol-1-yl)phenyl]methylidene]-4-(4-fluorophenyl)spiro[3,4,6,8-tetrahydropyrido[2,1-c][1,2,4]oxadiazine-7,1'-cyclopropane];(9E)-4-(4-fluorophenyl)-9-[[3-methoxy-4-(4-methylimidazol-1-yl)phenyl]methylidene]spiro[3,4,6,8-tetrahydropyrido[2,1-c][1,2,4]oxadiazine-7,1'-cyclopropane];(9E)-4-(4-fluorophenyl)-9-[[5-(4-methylimidazol-1-yl)-2-bicyclo[4.2.0]octa-1,3,5-trienyl]methylidene]spiro[3,4,6,8-tetrahydropyrido[2,1-c][1,2,4]oxadiazine-7,3'-oxetane];(9E)-4-(4-fluorophenyl)-3-methyl-9-[[7-(4-methylimidazol-1-yl)-1,2-benzothiazol-4-yl]methylidene]spiro[3,4,6,8-tetrahydropyrido[2,1-c][1,2,4]oxadiazine-7,3'-oxetane];(9E)-4-(4-fluorophenyl)-3-methyl-9-[[7-(4-methylimidazol-1-yl)-1,2-benzoxazol-4-yl]methylidene]spiro[3,4,6,8-tetrahydropyrido[2,1-c][1,2,4]oxadiazine-7,3'-oxetane];(9E)-4-(4-fluorophenyl)-9-[[3-methyl-7-(4-methylimidazol-1-yl)-1,2-benzoxazol-4-yl]methylidene]spiro[3,4,6,8-tetrahydropyrido[2,1-c][1,2,4]oxadiazine-7,3'-oxetane] is sourced from PubChem (CID 160688561), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).