4,15-diphenyl-25-oxa-4,15-diazaheptacyclo[14.11.0.02,14.03,11.05,10.018,26.019,24]heptacosa-1(16),2(14),3(11),5,7,9,12,17,19,21,23,26-dodecaene;10,15-diphenyl-24-oxa-10,15-diazaheptacyclo[14.11.0.02,14.03,11.04,9.017,25.018,23]heptacosa-1(16),2(14),3(11),4,6,8,12,17(25),18,20,22,26-dodecaene;15,18-diphenyl-11-oxa-15,18-diazaheptacyclo[14.11.0.02,14.04,12.05,10.017,25.019,24]heptacosa-1(16),2(14),3,5,7,9,12,17(25),19,21,23,26-dodecaene;15,25-diphenyl-4-oxa-15,25-diazaheptacyclo[14.11.0.02,14.03,11.05,10.018,26.019,24]heptacosa-1(16),2(14),3(11),5,7,9,12,17,19,21,23,26-dodecaene

C144H88N8O4 — CID 158966699

IUPAC4,15-diphenyl-25-oxa-4,15-diazaheptacyclo[14.11.0.02,14.03,11.05,10.018,26.019,24]heptacosa-1(16),2(14),3(11),5,7,9,12,17,19,21,23,26-dodecaene;10,15-diphenyl-24-oxa-10,15-diazaheptacyclo[14.11.0.02,14.03,11.04,9.017,25.018,23]heptacosa-1(16),2(14),3(11),4,6,8,12,17(25),18,20,22,26-dodecaene;15,18-diphenyl-11-oxa-15,18-diazaheptacyclo[14.11.0.02,14.04,12.05,10.017,25.019,24]heptacosa-1(16),2(14),3,5,7,9,12,17(25),19,21,23,26-dodecaene;15,25-diphenyl-4-oxa-15,25-diazaheptacyclo[14.11.0.02,14.03,11.05,10.018,26.019,24]heptacosa-1(16),2(14),3(11),5,7,9,12,17,19,21,23,26-dodecaene
SMILESc1ccc(-n2c3cc4c(cc3c3c2ccc2c5ccccc5n(-c5ccccc5)c23)oc2ccccc24)cc1.c1ccc(-n2c3ccccc3c3c4c5ccc6oc7ccccc7c6c5n(-c5ccccc5)c4ccc32)cc1.c1ccc(-n2c3ccccc3c3cc4c(cc32)c2c3oc5ccccc5c3ccc2n4-c2ccccc2)cc1.c1ccc(-n2c3ccccc3c3ccc4c5cc6c(cc5n(-c5ccccc5)c4c32)oc2ccccc26)cc1
InChIInChI=1S/4C36H22N2O/c1-3-11-23(12-4-1)37-28-17-9-7-15-25(28)33-29(37)20-21-30-34(33)27-19-22-32-35(26-16-8-10-18-31(26)39-32)36(27)38(30)24-13-5-2-6-14-24;1-3-11-23(12-4-1)37-30-17-9-7-15-25(30)28-21-33-29(22-32(28)37)35-31(38(33)24-13-5-2-6-14-24)20-19-27-26-16-8-10-18-34(26)39-36(27)35;1-3-11-23(12-4-1)37-31-20-19-27-25-15-7-9-17-30(25)38(24-13-5-2-6-14-24)36(27)35(31)29-22-34-28(21-32(29)37)26-16-8-10-18-33(26)39-34;1-3-11-23(12-4-1)37-31-17-9-7-15-25(31)27-19-20-28-29-21-30-26-16-8-10-18-33(26)39-34(30)22-32(29)38(36(28)35(27)37)24-13-5-2-6-14-24/h4*1-22H
InChIKeyJNHIJYVZZYYOHX-UHFFFAOYSA-N
MW1994.34 g/mol
LogP39.12
Rot. Bonds8

About 4,15-diphenyl-25-oxa-4,15-diazaheptacyclo[14.11.0.02,14.03,11.05,10.018,26.019,24]heptacosa-1(16),2(14),3(11),5,7,9,12,17,19,21,23,26-dodecaene;10,15-diphenyl-24-oxa-10,15-diazaheptacyclo[14.11.0.02,14.03,11.04,9.017,25.018,23]heptacosa-1(16),2(14),3(11),4,6,8,12,17(25),18,20,22,26-dodecaene;15,18-diphenyl-11-oxa-15,18-diazaheptacyclo[14.11.0.02,14.04,12.05,10.017,25.019,24]heptacosa-1(16),2(14),3,5,7,9,12,17(25),19,21,23,26-dodecaene;15,25-diphenyl-4-oxa-15,25-diazaheptacyclo[14.11.0.02,14.03,11.05,10.018,26.019,24]heptacosa-1(16),2(14),3(11),5,7,9,12,17,19,21,23,26-dodecaene

4,15-diphenyl-25-oxa-4,15-diazaheptacyclo[14.11.0.02,14.03,11.05,10.018,26.019,24]heptacosa-1(16),2(14),3(11),5,7,9,12,17,19,21,23,26-dodecaene;10,15-diphenyl-24-oxa-10,15-diazaheptacyclo[14.11.0.02,14.03,11.04,9.017,25.018,23]heptacosa-1(16),2(14),3(11),4,6,8,12,17(25),18,20,22,26-dodecaene;15,18-diphenyl-11-oxa-15,18-diazaheptacyclo[14.11.0.02,14.04,12.05,10.017,25.019,24]heptacosa-1(16),2(14),3,5,7,9,12,17(25),19,21,23,26-dodecaene;15,25-diphenyl-4-oxa-15,25-diazaheptacyclo[14.11.0.02,14.03,11.05,10.018,26.019,24]heptacosa-1(16),2(14),3(11),5,7,9,12,17,19,21,23,26-dodecaene (PubChem CID 158966699) has the molecular formula C144H88N8O4 and a molecular weight of 1994.34 g/mol. Its IUPAC name is 4,15-diphenyl-25-oxa-4,15-diazaheptacyclo[14.11.0.02,14.03,11.05,10.018,26.019,24]heptacosa-1(16),2(14),3(11),5,7,9,12,17,19,21,23,26-dodecaene;10,15-diphenyl-24-oxa-10,15-diazaheptacyclo[14.11.0.02,14.03,11.04,9.017,25.018,23]heptacosa-1(16),2(14),3(11),4,6,8,12,17(25),18,20,22,26-dodecaene;15,18-diphenyl-11-oxa-15,18-diazaheptacyclo[14.11.0.02,14.04,12.05,10.017,25.019,24]heptacosa-1(16),2(14),3,5,7,9,12,17(25),19,21,23,26-dodecaene;15,25-diphenyl-4-oxa-15,25-diazaheptacyclo[14.11.0.02,14.03,11.05,10.018,26.019,24]heptacosa-1(16),2(14),3(11),5,7,9,12,17,19,21,23,26-dodecaene.

Molecular Properties

Compound Name4,15-diphenyl-25-oxa-4,15-diazaheptacyclo[14.11.0.02,14.03,11.05,10.018,26.019,24]heptacosa-1(16),2(14),3(11),5,7,9,12,17,19,21,23,26-dodecaene;10,15-diphenyl-24-oxa-10,15-diazaheptacyclo[14.11.0.02,14.03,11.04,9.017,25.018,23]heptacosa-1(16),2(14),3(11),4,6,8,12,17(25),18,20,22,26-dodecaene;15,18-diphenyl-11-oxa-15,18-diazaheptacyclo[14.11.0.02,14.04,12.05,10.017,25.019,24]heptacosa-1(16),2(14),3,5,7,9,12,17(25),19,21,23,26-dodecaene;15,25-diphenyl-4-oxa-15,25-diazaheptacyclo[14.11.0.02,14.03,11.05,10.018,26.019,24]heptacosa-1(16),2(14),3(11),5,7,9,12,17,19,21,23,26-dodecaene
PubChem CID158966699
Molecular FormulaC144H88N8O4
Molecular Weight1994.34 g/mol
Exact Mass1992.69
IUPAC Name4,15-diphenyl-25-oxa-4,15-diazaheptacyclo[14.11.0.02,14.03,11.05,10.018,26.019,24]heptacosa-1(16),2(14),3(11),5,7,9,12,17,19,21,23,26-dodecaene;10,15-diphenyl-24-oxa-10,15-diazaheptacyclo[14.11.0.02,14.03,11.04,9.017,25.018,23]heptacosa-1(16),2(14),3(11),4,6,8,12,17(25),18,20,22,26-dodecaene;15,18-diphenyl-11-oxa-15,18-diazaheptacyclo[14.11.0.02,14.04,12.05,10.017,25.019,24]heptacosa-1(16),2(14),3,5,7,9,12,17(25),19,21,23,26-dodecaene;15,25-diphenyl-4-oxa-15,25-diazaheptacyclo[14.11.0.02,14.03,11.05,10.018,26.019,24]heptacosa-1(16),2(14),3(11),5,7,9,12,17,19,21,23,26-dodecaene
SMILESc1ccc(-n2c3cc4c(cc3c3c2ccc2c5ccccc5n(-c5ccccc5)c23)oc2ccccc24)cc1.c1ccc(-n2c3ccccc3c3c4c5ccc6oc7ccccc7c6c5n(-c5ccccc5)c4ccc32)cc1.c1ccc(-n2c3ccccc3c3cc4c(cc32)c2c3oc5ccccc5c3ccc2n4-c2ccccc2)cc1.c1ccc(-n2c3ccccc3c3ccc4c5cc6c(cc5n(-c5ccccc5)c4c32)oc2ccccc26)cc1
InChIInChI=1S/4C36H22N2O/c1-3-11-23(12-4-1)37-28-17-9-7-15-25(28)33-29(37)20-21-30-34(33)27-19-22-32-35(26-16-8-10-18-31(26)39-32)36(27)38(30)24-13-5-2-6-14-24;1-3-11-23(12-4-1)37-30-17-9-7-15-25(30)28-21-33-29(22-32(28)37)35-31(38(33)24-13-5-2-6-14-24)20-19-27-26-16-8-10-18-34(26)39-36(27)35;1-3-11-23(12-4-1)37-31-20-19-27-25-15-7-9-17-30(25)38(24-13-5-2-6-14-24)36(27)35(31)29-22-34-28(21-32(29)37)26-16-8-10-18-33(26)39-34;1-3-11-23(12-4-1)37-31-17-9-7-15-25(31)27-19-20-28-29-21-30-26-16-8-10-18-33(26)39-34(30)22-32(29)38(36(28)35(27)37)24-13-5-2-6-14-24/h4*1-22H
InChIKeyJNHIJYVZZYYOHX-UHFFFAOYSA-N
XLogP39.12
TPSA92.00 Ų
H-Bond Donors
H-Bond Acceptors12
Rotatable Bonds8
Heavy Atoms156
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001994.34
LogP ≤ 539.12
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1012

Analyze 4,15-diphenyl-25-oxa-4,15-diazaheptacyclo[14.11.0.02,14.03,11.05,10.018,26.019,24]heptacosa-1(16),2(14),3(11),5,7,9,12,17,19,21,23,26-dodecaene;10,15-diphenyl-24-oxa-10,15-diazaheptacyclo[14.11.0.02,14.03,11.04,9.017,25.018,23]heptacosa-1(16),2(14),3(11),4,6,8,12,17(25),18,20,22,26-dodecaene;15,18-diphenyl-11-oxa-15,18-diazaheptacyclo[14.11.0.02,14.04,12.05,10.017,25.019,24]heptacosa-1(16),2(14),3,5,7,9,12,17(25),19,21,23,26-dodecaene;15,25-diphenyl-4-oxa-15,25-diazaheptacyclo[14.11.0.02,14.03,11.05,10.018,26.019,24]heptacosa-1(16),2(14),3(11),5,7,9,12,17,19,21,23,26-dodecaene with MolForge

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Related Compounds

12-naphthalen-1-yl-[1]benzofuro[3,2-a]carbazole;14-naphthalen-1-yl-9-oxa-14-azapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene;12-phenyl-[1]benzofuro[3,2-a]carbazole;bis(7-phenyl-[1]benzofuro[2,3-b]carbazole);5-phenyl-[1]benzofuro[3,2-c]carbazole;14-phenyl-9-oxa-14-azapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene
CID 158446941
15,19-diphenyl-4-oxa-15,19-diazaheptacyclo[14.11.0.02,14.03,11.05,10.018,26.020,25]heptacosa-1(16),2(14),3(11),5,7,9,12,17,20,22,24,26-dodecaene
CID 126679130
12-dibenzofuran-2-yl-[1]benzofuro[3,2-a]carbazole;5-dibenzofuran-2-yl-[1]benzofuro[3,2-c]carbazole;14-dibenzofuran-2-yl-9-oxa-14-azapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene;12-dibenzothiophen-2-yl-[1]benzofuro[3,2-a]carbazole;7-dibenzothiophen-2-yl-[1]benzofuro[2,3-b]carbazole;14-dibenzothiophen-2-yl-9-oxa-14-azapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene
CID 159688697
3-([1]benzofuro[2,3-a]carbazol-12-yl)-5-(4-carbazol-9-ylphenyl)benzonitrile;3-([1]benzofuro[3,2-a]carbazol-12-yl)-5-(4-carbazol-9-ylphenyl)benzonitrile;3-([1]benzofuro[2,3-b]carbazol-7-yl)-5-(4-carbazol-9-ylphenyl)benzonitrile;3-([1]benzofuro[3,2-b]carbazol-11-yl)-5-(4-carbazol-9-ylphenyl)benzonitrile;3-[4-([1]benzofuro[3,2-c]carbazol-5-yl)phenyl]-5-carbazol-9-ylbenzonitrile;3-carbazol-9-yl-5-[4-(9-oxa-14-azapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaen-14-yl)phenyl]benzonitrile
CID 157319826
3-([1]benzofuro[2,3-a]carbazol-12-yl)-5-(4-carbazol-9-ylphenyl)benzonitrile;3-([1]benzofuro[3,2-a]carbazol-12-yl)-5-(4-carbazol-9-ylphenyl)benzonitrile;3-([1]benzofuro[2,3-b]carbazol-7-yl)-5-(4-carbazol-9-ylphenyl)benzonitrile;3-([1]benzofuro[3,2-b]carbazol-11-yl)-5-(4-carbazol-9-ylphenyl)benzonitrile;3-([1]benzofuro[3,2-c]carbazol-5-yl)-5-(4-carbazol-9-ylphenyl)benzonitrile;3-(4-carbazol-9-ylphenyl)-5-(9-oxa-14-azapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaen-14-yl)benzonitrile
CID 165076473
5-([1]benzofuro[2,3-a]carbazol-12-yl)-2-(4-carbazol-9-ylphenyl)benzonitrile;5-([1]benzofuro[3,2-a]carbazol-12-yl)-2-(4-carbazol-9-ylphenyl)benzonitrile;5-([1]benzofuro[2,3-b]carbazol-7-yl)-2-(4-carbazol-9-ylphenyl)benzonitrile;5-([1]benzofuro[3,2-b]carbazol-11-yl)-2-(4-carbazol-9-ylphenyl)benzonitrile;5-([1]benzofuro[3,2-c]carbazol-5-yl)-2-(4-carbazol-9-ylphenyl)benzonitrile;2-(4-carbazol-9-ylphenyl)-5-(9-oxa-14-azapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaen-14-yl)benzonitrile
CID 165038768
15,24-diphenyl-10-oxa-15,24-diazaheptacyclo[14.11.0.02,14.03,11.04,9.017,25.018,23]heptacosa-1(16),2(14),3(11),4,6,8,12,17(25),18,20,22,26-dodecaene
CID 126679108
5-phenyl-12-[8-[3-(5-phenylindolo[3,2-c]carbazol-12-yl)carbazol-9-yl]dibenzofuran-4-yl]indolo[3,2-c]carbazole
CID 123179485
15,24-diphenyl-6-oxa-15,24-diazaheptacyclo[14.11.0.02,14.05,13.07,12.017,25.018,23]heptacosa-1(16),2(14),3,5(13),7,9,11,17(25),18,20,22,26-dodecaene
CID 126679131
3-([1]benzofuro[2,3-b]carbazol-7-yl)-5-[3-([1]benzofuro[2,3-b]carbazol-7-yl)-5-cyanophenyl]benzonitrile;3-([1]benzofuro[3,2-b]carbazol-11-yl)-5-[3-([1]benzofuro[3,2-b]carbazol-11-yl)-5-cyanophenyl]benzonitrile;3-([1]benzofuro[3,2-c]carbazol-5-yl)-5-[3-([1]benzofuro[3,2-c]carbazol-5-yl)-5-cyanophenyl]benzonitrile;3-[3-cyano-5-(9-oxa-14-azapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaen-14-yl)phenyl]-5-(9-oxa-14-azapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaen-14-yl)benzonitrile
CID 160752730
7-phenyl-9-(14-phenyl-9-oxa-14-azapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15(20),16,18-nonaen-18-yl)-[1]benzofuro[2,3-b]carbazole
CID 134223509
5-phenyl-3-(14-phenyl-9-oxa-14-azapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15(20),16,18-nonaen-18-yl)-[1]benzofuro[3,2-c]carbazole
CID 134223386

Frequently Asked Questions

What is the IUPAC name of 4,15-diphenyl-25-oxa-4,15-diazaheptacyclo[14.11.0.02,14.03,11.05,10.018,26.019,24]heptacosa-1(16),2(14),3(11),5,7,9,12,17,19,21,23,26-dodecaene;10,15-diphenyl-24-oxa-10,15-diazaheptacyclo[14.11.0.02,14.03,11.04,9.017,25.018,23]heptacosa-1(16),2(14),3(11),4,6,8,12,17(25),18,20,22,26-dodecaene;15,18-diphenyl-11-oxa-15,18-diazaheptacyclo[14.11.0.02,14.04,12.05,10.017,25.019,24]heptacosa-1(16),2(14),3,5,7,9,12,17(25),19,21,23,26-dodecaene;15,25-diphenyl-4-oxa-15,25-diazaheptacyclo[14.11.0.02,14.03,11.05,10.018,26.019,24]heptacosa-1(16),2(14),3(11),5,7,9,12,17,19,21,23,26-dodecaene?
The IUPAC name of 4,15-diphenyl-25-oxa-4,15-diazaheptacyclo[14.11.0.02,14.03,11.05,10.018,26.019,24]heptacosa-1(16),2(14),3(11),5,7,9,12,17,19,21,23,26-dodecaene;10,15-diphenyl-24-oxa-10,15-diazaheptacyclo[14.11.0.02,14.03,11.04,9.017,25.018,23]heptacosa-1(16),2(14),3(11),4,6,8,12,17(25),18,20,22,26-dodecaene;15,18-diphenyl-11-oxa-15,18-diazaheptacyclo[14.11.0.02,14.04,12.05,10.017,25.019,24]heptacosa-1(16),2(14),3,5,7,9,12,17(25),19,21,23,26-dodecaene;15,25-diphenyl-4-oxa-15,25-diazaheptacyclo[14.11.0.02,14.03,11.05,10.018,26.019,24]heptacosa-1(16),2(14),3(11),5,7,9,12,17,19,21,23,26-dodecaene (CID 158966699) is 4,15-diphenyl-25-oxa-4,15-diazaheptacyclo[14.11.0.02,14.03,11.05,10.018,26.019,24]heptacosa-1(16),2(14),3(11),5,7,9,12,17,19,21,23,26-dodecaene;10,15-diphenyl-24-oxa-10,15-diazaheptacyclo[14.11.0.02,14.03,11.04,9.017,25.018,23]heptacosa-1(16),2(14),3(11),4,6,8,12,17(25),18,20,22,26-dodecaene;15,18-diphenyl-11-oxa-15,18-diazaheptacyclo[14.11.0.02,14.04,12.05,10.017,25.019,24]heptacosa-1(16),2(14),3,5,7,9,12,17(25),19,21,23,26-dodecaene;15,25-diphenyl-4-oxa-15,25-diazaheptacyclo[14.11.0.02,14.03,11.05,10.018,26.019,24]heptacosa-1(16),2(14),3(11),5,7,9,12,17,19,21,23,26-dodecaene.
What is the SMILES notation for 4,15-diphenyl-25-oxa-4,15-diazaheptacyclo[14.11.0.02,14.03,11.05,10.018,26.019,24]heptacosa-1(16),2(14),3(11),5,7,9,12,17,19,21,23,26-dodecaene;10,15-diphenyl-24-oxa-10,15-diazaheptacyclo[14.11.0.02,14.03,11.04,9.017,25.018,23]heptacosa-1(16),2(14),3(11),4,6,8,12,17(25),18,20,22,26-dodecaene;15,18-diphenyl-11-oxa-15,18-diazaheptacyclo[14.11.0.02,14.04,12.05,10.017,25.019,24]heptacosa-1(16),2(14),3,5,7,9,12,17(25),19,21,23,26-dodecaene;15,25-diphenyl-4-oxa-15,25-diazaheptacyclo[14.11.0.02,14.03,11.05,10.018,26.019,24]heptacosa-1(16),2(14),3(11),5,7,9,12,17,19,21,23,26-dodecaene?
The canonical SMILES for 4,15-diphenyl-25-oxa-4,15-diazaheptacyclo[14.11.0.02,14.03,11.05,10.018,26.019,24]heptacosa-1(16),2(14),3(11),5,7,9,12,17,19,21,23,26-dodecaene;10,15-diphenyl-24-oxa-10,15-diazaheptacyclo[14.11.0.02,14.03,11.04,9.017,25.018,23]heptacosa-1(16),2(14),3(11),4,6,8,12,17(25),18,20,22,26-dodecaene;15,18-diphenyl-11-oxa-15,18-diazaheptacyclo[14.11.0.02,14.04,12.05,10.017,25.019,24]heptacosa-1(16),2(14),3,5,7,9,12,17(25),19,21,23,26-dodecaene;15,25-diphenyl-4-oxa-15,25-diazaheptacyclo[14.11.0.02,14.03,11.05,10.018,26.019,24]heptacosa-1(16),2(14),3(11),5,7,9,12,17,19,21,23,26-dodecaene is c1ccc(-n2c3cc4c(cc3c3c2ccc2c5ccccc5n(-c5ccccc5)c23)oc2ccccc24)cc1.c1ccc(-n2c3ccccc3c3c4c5ccc6oc7ccccc7c6c5n(-c5ccccc5)c4ccc32)cc1.c1ccc(-n2c3ccccc3c3cc4c(cc32)c2c3oc5ccccc5c3ccc2n4-c2ccccc2)cc1.c1ccc(-n2c3ccccc3c3ccc4c5cc6c(cc5n(-c5ccccc5)c4c32)oc2ccccc26)cc1.
What is the InChIKey of 4,15-diphenyl-25-oxa-4,15-diazaheptacyclo[14.11.0.02,14.03,11.05,10.018,26.019,24]heptacosa-1(16),2(14),3(11),5,7,9,12,17,19,21,23,26-dodecaene;10,15-diphenyl-24-oxa-10,15-diazaheptacyclo[14.11.0.02,14.03,11.04,9.017,25.018,23]heptacosa-1(16),2(14),3(11),4,6,8,12,17(25),18,20,22,26-dodecaene;15,18-diphenyl-11-oxa-15,18-diazaheptacyclo[14.11.0.02,14.04,12.05,10.017,25.019,24]heptacosa-1(16),2(14),3,5,7,9,12,17(25),19,21,23,26-dodecaene;15,25-diphenyl-4-oxa-15,25-diazaheptacyclo[14.11.0.02,14.03,11.05,10.018,26.019,24]heptacosa-1(16),2(14),3(11),5,7,9,12,17,19,21,23,26-dodecaene?
The InChIKey is JNHIJYVZZYYOHX-UHFFFAOYSA-N. The full InChI is InChI=1S/4C36H22N2O/c1-3-11-23(12-4-1)37-28-17-9-7-15-25(28)33-29(37)20-21-30-34(33)27-19-22-32-35(26-16-8-10-18-31(26)39-32)36(27)38(30)24-13-5-2-6-14-24;1-3-11-23(12-4-1)37-30-17-9-7-15-25(30)28-21-33-29(22-32(28)37)35-31(38(33)24-13-5-2-6-14-24)20-19-27-26-16-8-10-18-34(26)39-36(27)35;1-3-11-23(12-4-1)37-31-20-19-27-25-15-7-9-17-30(25)38(24-13-5-2-6-14-24)36(27)35(31)29-22-34-28(21-32(29)37)26-16-8-10-18-33(26)39-34;1-3-11-23(12-4-1)37-31-17-9-7-15-25(31)27-19-20-28-29-21-30-26-16-8-10-18-33(26)39-34(30)22-32(29)38(36(28)35(27)37)24-13-5-2-6-14-24/h4*1-22H.
What are the key properties of 4,15-diphenyl-25-oxa-4,15-diazaheptacyclo[14.11.0.02,14.03,11.05,10.018,26.019,24]heptacosa-1(16),2(14),3(11),5,7,9,12,17,19,21,23,26-dodecaene;10,15-diphenyl-24-oxa-10,15-diazaheptacyclo[14.11.0.02,14.03,11.04,9.017,25.018,23]heptacosa-1(16),2(14),3(11),4,6,8,12,17(25),18,20,22,26-dodecaene;15,18-diphenyl-11-oxa-15,18-diazaheptacyclo[14.11.0.02,14.04,12.05,10.017,25.019,24]heptacosa-1(16),2(14),3,5,7,9,12,17(25),19,21,23,26-dodecaene;15,25-diphenyl-4-oxa-15,25-diazaheptacyclo[14.11.0.02,14.03,11.05,10.018,26.019,24]heptacosa-1(16),2(14),3(11),5,7,9,12,17,19,21,23,26-dodecaene?
4,15-diphenyl-25-oxa-4,15-diazaheptacyclo[14.11.0.02,14.03,11.05,10.018,26.019,24]heptacosa-1(16),2(14),3(11),5,7,9,12,17,19,21,23,26-dodecaene;10,15-diphenyl-24-oxa-10,15-diazaheptacyclo[14.11.0.02,14.03,11.04,9.017,25.018,23]heptacosa-1(16),2(14),3(11),4,6,8,12,17(25),18,20,22,26-dodecaene;15,18-diphenyl-11-oxa-15,18-diazaheptacyclo[14.11.0.02,14.04,12.05,10.017,25.019,24]heptacosa-1(16),2(14),3,5,7,9,12,17(25),19,21,23,26-dodecaene;15,25-diphenyl-4-oxa-15,25-diazaheptacyclo[14.11.0.02,14.03,11.05,10.018,26.019,24]heptacosa-1(16),2(14),3(11),5,7,9,12,17,19,21,23,26-dodecaene has a molecular weight of 1994.34 g/mol, XLogP of 39.12, 8 rotatable bonds, 0 hydrogen bond donors, and 12 hydrogen bond acceptors.
Where does this data come from?
All data for 4,15-diphenyl-25-oxa-4,15-diazaheptacyclo[14.11.0.02,14.03,11.05,10.018,26.019,24]heptacosa-1(16),2(14),3(11),5,7,9,12,17,19,21,23,26-dodecaene;10,15-diphenyl-24-oxa-10,15-diazaheptacyclo[14.11.0.02,14.03,11.04,9.017,25.018,23]heptacosa-1(16),2(14),3(11),4,6,8,12,17(25),18,20,22,26-dodecaene;15,18-diphenyl-11-oxa-15,18-diazaheptacyclo[14.11.0.02,14.04,12.05,10.017,25.019,24]heptacosa-1(16),2(14),3,5,7,9,12,17(25),19,21,23,26-dodecaene;15,25-diphenyl-4-oxa-15,25-diazaheptacyclo[14.11.0.02,14.03,11.05,10.018,26.019,24]heptacosa-1(16),2(14),3(11),5,7,9,12,17,19,21,23,26-dodecaene is sourced from PubChem (CID 158966699), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).