9-carbazol-9-yl-5,15-dioxa-1,24-diaza-16-boraheptacyclo[14.12.0.02,14.04,12.06,11.017,22.023,28]octacosa-2(14),3,6(11),7,9,12,17,19,21,23(28),24,26-dodecaene;25-carbazol-9-yl-5,15-dioxa-1,24-diaza-16-boraheptacyclo[14.12.0.02,14.04,12.06,11.017,22.023,28]octacosa-2(14),3,6,8,10,12,17,19,21,23(28),24,26-dodecaene;5-carbazol-9-yl-21-oxa-4,14-diaza-1-borapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-2,4,6,8,10,12,15,17,19-nonaene;10-carbazol-9-yl-21-oxa-4,14-diaza-1-borapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-2(7),3,5,8(13),9,11,15,17,19-nonaene;21-oxa-4,14-diaza-1-borapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-2(7),3,5,8,10,12,15,17,19-nonaene

C145H87B5N14O7 — CID 162044453

IUPAC9-carbazol-9-yl-5,15-dioxa-1,24-diaza-16-boraheptacyclo[14.12.0.02,14.04,12.06,11.017,22.023,28]octacosa-2(14),3,6(11),7,9,12,17,19,21,23(28),24,26-dodecaene;25-carbazol-9-yl-5,15-dioxa-1,24-diaza-16-boraheptacyclo[14.12.0.02,14.04,12.06,11.017,22.023,28]octacosa-2(14),3,6,8,10,12,17,19,21,23(28),24,26-dodecaene;5-carbazol-9-yl-21-oxa-4,14-diaza-1-borapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-2,4,6,8,10,12,15,17,19-nonaene;10-carbazol-9-yl-21-oxa-4,14-diaza-1-borapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-2(7),3,5,8(13),9,11,15,17,19-nonaene;21-oxa-4,14-diaza-1-borapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-2(7),3,5,8,10,12,15,17,19-nonaene
SMILESc1ccc2c(c1)B1Oc3cc4c(cc3N1c1ccc(-n3c5ccccc5c5ccccc53)nc1-2)oc1ccccc14.c1ccc2c(c1)B1Oc3cc4c(cc3N1c1cccnc1-2)oc1ccc(-n2c3ccccc3c3ccccc32)cc14.c1ccc2c(c1)OB1c3cnc(-n4c5ccccc5c5ccccc54)cc3-c3ccccc3N12.c1ccc2c(c1)OB1c3cnccc3-c3cc(-n4c5ccccc5c5ccccc54)ccc3N12.c1ccc2c(c1)OB1c3cnccc3-c3ccccc3N12
InChIInChI=1S/2C35H20BN3O2.2C29H18BN3O.C17H11BN2O/c1-5-13-26-24(12-1)35-29(17-18-34(37-35)38-27-14-6-2-9-21(27)22-10-3-7-15-28(22)38)39-30-20-32-25(19-33(30)41-36(26)39)23-11-4-8-16-31(23)40-32;1-4-11-27-24(10-1)35-30(14-7-17-37-35)39-31-20-33-26(19-34(31)41-36(27)39)25-18-21(15-16-32(25)40-33)38-28-12-5-2-8-22(28)23-9-3-6-13-29(23)38;1-4-12-24-19(9-1)20-10-2-5-13-25(20)32(24)29-17-22-21-11-3-6-14-26(21)33-27-15-7-8-16-28(27)34-30(33)23(22)18-31-29;1-3-9-25-21(7-1)22-8-2-4-10-26(22)32(25)19-13-14-27-23(17-19)20-15-16-31-18-24(20)30-33(27)28-11-5-6-12-29(28)34-30;1-2-6-15-13(5-1)12-9-10-19-11-14(12)18-20(15)16-7-3-4-8-17(16)21-18/h2*1-20H;2*1-18H;1-11H
InChIKeyYXRYLRFSFHXALL-UHFFFAOYSA-N
MW2191.44 g/mol
LogP31.13
Rot. Bonds4

About 9-carbazol-9-yl-5,15-dioxa-1,24-diaza-16-boraheptacyclo[14.12.0.02,14.04,12.06,11.017,22.023,28]octacosa-2(14),3,6(11),7,9,12,17,19,21,23(28),24,26-dodecaene;25-carbazol-9-yl-5,15-dioxa-1,24-diaza-16-boraheptacyclo[14.12.0.02,14.04,12.06,11.017,22.023,28]octacosa-2(14),3,6,8,10,12,17,19,21,23(28),24,26-dodecaene;5-carbazol-9-yl-21-oxa-4,14-diaza-1-borapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-2,4,6,8,10,12,15,17,19-nonaene;10-carbazol-9-yl-21-oxa-4,14-diaza-1-borapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-2(7),3,5,8(13),9,11,15,17,19-nonaene;21-oxa-4,14-diaza-1-borapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-2(7),3,5,8,10,12,15,17,19-nonaene

9-carbazol-9-yl-5,15-dioxa-1,24-diaza-16-boraheptacyclo[14.12.0.02,14.04,12.06,11.017,22.023,28]octacosa-2(14),3,6(11),7,9,12,17,19,21,23(28),24,26-dodecaene;25-carbazol-9-yl-5,15-dioxa-1,24-diaza-16-boraheptacyclo[14.12.0.02,14.04,12.06,11.017,22.023,28]octacosa-2(14),3,6,8,10,12,17,19,21,23(28),24,26-dodecaene;5-carbazol-9-yl-21-oxa-4,14-diaza-1-borapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-2,4,6,8,10,12,15,17,19-nonaene;10-carbazol-9-yl-21-oxa-4,14-diaza-1-borapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-2(7),3,5,8(13),9,11,15,17,19-nonaene;21-oxa-4,14-diaza-1-borapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-2(7),3,5,8,10,12,15,17,19-nonaene (PubChem CID 162044453) has the molecular formula C145H87B5N14O7 and a molecular weight of 2191.44 g/mol. Its IUPAC name is 9-carbazol-9-yl-5,15-dioxa-1,24-diaza-16-boraheptacyclo[14.12.0.02,14.04,12.06,11.017,22.023,28]octacosa-2(14),3,6(11),7,9,12,17,19,21,23(28),24,26-dodecaene;25-carbazol-9-yl-5,15-dioxa-1,24-diaza-16-boraheptacyclo[14.12.0.02,14.04,12.06,11.017,22.023,28]octacosa-2(14),3,6,8,10,12,17,19,21,23(28),24,26-dodecaene;5-carbazol-9-yl-21-oxa-4,14-diaza-1-borapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-2,4,6,8,10,12,15,17,19-nonaene;10-carbazol-9-yl-21-oxa-4,14-diaza-1-borapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-2(7),3,5,8(13),9,11,15,17,19-nonaene;21-oxa-4,14-diaza-1-borapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-2(7),3,5,8,10,12,15,17,19-nonaene.

Molecular Properties

Compound Name9-carbazol-9-yl-5,15-dioxa-1,24-diaza-16-boraheptacyclo[14.12.0.02,14.04,12.06,11.017,22.023,28]octacosa-2(14),3,6(11),7,9,12,17,19,21,23(28),24,26-dodecaene;25-carbazol-9-yl-5,15-dioxa-1,24-diaza-16-boraheptacyclo[14.12.0.02,14.04,12.06,11.017,22.023,28]octacosa-2(14),3,6,8,10,12,17,19,21,23(28),24,26-dodecaene;5-carbazol-9-yl-21-oxa-4,14-diaza-1-borapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-2,4,6,8,10,12,15,17,19-nonaene;10-carbazol-9-yl-21-oxa-4,14-diaza-1-borapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-2(7),3,5,8(13),9,11,15,17,19-nonaene;21-oxa-4,14-diaza-1-borapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-2(7),3,5,8,10,12,15,17,19-nonaene
PubChem CID162044453
Molecular FormulaC145H87B5N14O7
Molecular Weight2191.44 g/mol
Exact Mass2190.73
IUPAC Name9-carbazol-9-yl-5,15-dioxa-1,24-diaza-16-boraheptacyclo[14.12.0.02,14.04,12.06,11.017,22.023,28]octacosa-2(14),3,6(11),7,9,12,17,19,21,23(28),24,26-dodecaene;25-carbazol-9-yl-5,15-dioxa-1,24-diaza-16-boraheptacyclo[14.12.0.02,14.04,12.06,11.017,22.023,28]octacosa-2(14),3,6,8,10,12,17,19,21,23(28),24,26-dodecaene;5-carbazol-9-yl-21-oxa-4,14-diaza-1-borapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-2,4,6,8,10,12,15,17,19-nonaene;10-carbazol-9-yl-21-oxa-4,14-diaza-1-borapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-2(7),3,5,8(13),9,11,15,17,19-nonaene;21-oxa-4,14-diaza-1-borapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-2(7),3,5,8,10,12,15,17,19-nonaene
SMILESc1ccc2c(c1)B1Oc3cc4c(cc3N1c1ccc(-n3c5ccccc5c5ccccc53)nc1-2)oc1ccccc14.c1ccc2c(c1)B1Oc3cc4c(cc3N1c1cccnc1-2)oc1ccc(-n2c3ccccc3c3ccccc32)cc14.c1ccc2c(c1)OB1c3cnc(-n4c5ccccc5c5ccccc54)cc3-c3ccccc3N12.c1ccc2c(c1)OB1c3cnccc3-c3cc(-n4c5ccccc5c5ccccc54)ccc3N12.c1ccc2c(c1)OB1c3cnccc3-c3ccccc3N12
InChIInChI=1S/2C35H20BN3O2.2C29H18BN3O.C17H11BN2O/c1-5-13-26-24(12-1)35-29(17-18-34(37-35)38-27-14-6-2-9-21(27)22-10-3-7-15-28(22)38)39-30-20-32-25(19-33(30)41-36(26)39)23-11-4-8-16-31(23)40-32;1-4-11-27-24(10-1)35-30(14-7-17-37-35)39-31-20-33-26(19-34(31)41-36(27)39)25-18-21(15-16-32(25)40-33)38-28-12-5-2-8-22(28)23-9-3-6-13-29(23)38;1-4-12-24-19(9-1)20-10-2-5-13-25(20)32(24)29-17-22-21-11-3-6-14-26(21)33-27-15-7-8-16-28(27)34-30(33)23(22)18-31-29;1-3-9-25-21(7-1)22-8-2-4-10-26(22)32(25)19-13-14-27-23(17-19)20-15-16-31-18-24(20)30-33(27)28-11-5-6-12-29(28)34-30;1-2-6-15-13(5-1)12-9-10-19-11-14(12)18-20(15)16-7-3-4-8-17(16)21-18/h2*1-20H;2*1-18H;1-11H
InChIKeyYXRYLRFSFHXALL-UHFFFAOYSA-N
XLogP31.13
TPSA172.80 Ų
H-Bond Donors
H-Bond Acceptors21
Rotatable Bonds4
Heavy Atoms171
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002191.44
LogP ≤ 531.13
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1021

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}

Analyze 9-carbazol-9-yl-5,15-dioxa-1,24-diaza-16-boraheptacyclo[14.12.0.02,14.04,12.06,11.017,22.023,28]octacosa-2(14),3,6(11),7,9,12,17,19,21,23(28),24,26-dodecaene;25-carbazol-9-yl-5,15-dioxa-1,24-diaza-16-boraheptacyclo[14.12.0.02,14.04,12.06,11.017,22.023,28]octacosa-2(14),3,6,8,10,12,17,19,21,23(28),24,26-dodecaene;5-carbazol-9-yl-21-oxa-4,14-diaza-1-borapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-2,4,6,8,10,12,15,17,19-nonaene;10-carbazol-9-yl-21-oxa-4,14-diaza-1-borapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-2(7),3,5,8(13),9,11,15,17,19-nonaene;21-oxa-4,14-diaza-1-borapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-2(7),3,5,8,10,12,15,17,19-nonaene with MolForge

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Related Compounds

25-carbazol-9-yl-5,15-dioxa-1,24-diaza-16-boraheptacyclo[14.12.0.02,14.04,12.06,11.017,22.023,28]octacosa-2(14),3,6,8,10,12,17,19,21,23(28),24,26-dodecaene
CID 140821534
8-[3-(6-dibenzofuran-2-yl-2-pyridinyl)carbazol-9-yl]-5-pyridin-3-yl-2-[3-(2-pyridin-3-ylphenyl)carbazol-9-yl]pyrido[3,2-b]indole
CID 58501596
11,16-di(carbazol-9-yl)-30-oxa-3-azaheptacyclo[18.12.0.02,7.08,13.014,19.022,31.024,29]dotriaconta-1(20),2(7),3,5,8(13),9,11,14(19),15,17,21,24,26,28,31-pentadecaen-23-one
CID 134428472
24-dibenzofuran-2-yl-8-phenyl-8,20,24-triazahexacyclo[13.11.0.02,7.09,14.017,25.018,23]hexacosa-1(15),2,4,6,9,11,13,16,18(23),19,21,25-dodecaene
CID 118363300
8-carbazol-9-yl-[1]benzofuro[2,3-b]pyridine;6-carbazol-9-yl-[1]benzofuro[2,3-c]pyridine
CID 144782335
14-carbazol-9-yl-9,24-dioxa-2-aza-10-borahexacyclo[15.7.0.02,10.03,8.011,16.018,23]tetracosa-1(17),3,5,7,11(16),12,14,18,20,22-decaene;16-dibenzofuran-4-yl-3,14-dioxa-1-aza-13-borapentacyclo[11.7.0.02,6.07,12.015,20]icosa-2(6),4,7,9,11,15,17,19-octaene;9,24-dioxa-2-aza-10-borahexacyclo[15.7.0.02,10.03,8.011,16.018,23]tetracosa-1(17),3,5,7,11,13,15,18,20,22-decaene
CID 160769007
3-(8-carbazol-9-yldibenzofuran-2-yl)-9-[8-[3-(8-carbazol-9-yldibenzofuran-2-yl)carbazol-9-yl]dibenzofuran-2-yl]carbazole;3-(8-carbazol-9-yldibenzofuran-2-yl)-9-[2-(3-phenyl-2-pyridinyl)phenyl]carbazole;9-[8-(3,6-dipyridin-2-ylcarbazol-9-yl)dibenzofuran-2-yl]-3,6-dipyridin-2-ylcarbazole;9-phenyl-3,6-bis(3-phenylcarbazol-9-yl)carbazole
CID 161188676
1-[3-(3-carbazol-9-ylcarbazol-9-yl)tetraphenylen-2-yl]-[1]benzofuro[2,3-c]pyridine
CID 168811265
3-pyridin-3-yl-9-(8-pyridin-3-yldibenzofuran-2-yl)carbazole
CID 163439035
3-carbazol-9-yl-9-(9-dibenzofuran-2-ylcarbazol-3-yl)carbazole;3-carbazol-9-yl-9-(9-dibenzofuran-3-ylcarbazol-3-yl)carbazole;3-carbazol-9-yl-9-(9-dibenzofuran-4-ylcarbazol-3-yl)carbazole
CID 161172742
1-carbazol-9-yl-6-(3-carbazol-9-ylcarbazol-9-yl)-[1]benzofuro[2,3-c]pyridine;3-carbazol-9-yl-1-(3-carbazol-9-ylcarbazol-9-yl)-[1]benzofuro[2,3-c]pyridine;6-carbazol-9-yl-1-(3-carbazol-9-ylcarbazol-9-yl)-[1]benzofuro[2,3-c]pyridine
CID 157234623
3-[9-[5-(4-dibenzofuran-2-ylphenyl)-2-pyridinyl]carbazol-3-yl]-9-phenylcarbazole
CID 90086397

Frequently Asked Questions

What is the IUPAC name of 9-carbazol-9-yl-5,15-dioxa-1,24-diaza-16-boraheptacyclo[14.12.0.02,14.04,12.06,11.017,22.023,28]octacosa-2(14),3,6(11),7,9,12,17,19,21,23(28),24,26-dodecaene;25-carbazol-9-yl-5,15-dioxa-1,24-diaza-16-boraheptacyclo[14.12.0.02,14.04,12.06,11.017,22.023,28]octacosa-2(14),3,6,8,10,12,17,19,21,23(28),24,26-dodecaene;5-carbazol-9-yl-21-oxa-4,14-diaza-1-borapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-2,4,6,8,10,12,15,17,19-nonaene;10-carbazol-9-yl-21-oxa-4,14-diaza-1-borapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-2(7),3,5,8(13),9,11,15,17,19-nonaene;21-oxa-4,14-diaza-1-borapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-2(7),3,5,8,10,12,15,17,19-nonaene?
The IUPAC name of 9-carbazol-9-yl-5,15-dioxa-1,24-diaza-16-boraheptacyclo[14.12.0.02,14.04,12.06,11.017,22.023,28]octacosa-2(14),3,6(11),7,9,12,17,19,21,23(28),24,26-dodecaene;25-carbazol-9-yl-5,15-dioxa-1,24-diaza-16-boraheptacyclo[14.12.0.02,14.04,12.06,11.017,22.023,28]octacosa-2(14),3,6,8,10,12,17,19,21,23(28),24,26-dodecaene;5-carbazol-9-yl-21-oxa-4,14-diaza-1-borapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-2,4,6,8,10,12,15,17,19-nonaene;10-carbazol-9-yl-21-oxa-4,14-diaza-1-borapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-2(7),3,5,8(13),9,11,15,17,19-nonaene;21-oxa-4,14-diaza-1-borapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-2(7),3,5,8,10,12,15,17,19-nonaene (CID 162044453) is 9-carbazol-9-yl-5,15-dioxa-1,24-diaza-16-boraheptacyclo[14.12.0.02,14.04,12.06,11.017,22.023,28]octacosa-2(14),3,6(11),7,9,12,17,19,21,23(28),24,26-dodecaene;25-carbazol-9-yl-5,15-dioxa-1,24-diaza-16-boraheptacyclo[14.12.0.02,14.04,12.06,11.017,22.023,28]octacosa-2(14),3,6,8,10,12,17,19,21,23(28),24,26-dodecaene;5-carbazol-9-yl-21-oxa-4,14-diaza-1-borapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-2,4,6,8,10,12,15,17,19-nonaene;10-carbazol-9-yl-21-oxa-4,14-diaza-1-borapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-2(7),3,5,8(13),9,11,15,17,19-nonaene;21-oxa-4,14-diaza-1-borapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-2(7),3,5,8,10,12,15,17,19-nonaene.
What is the SMILES notation for 9-carbazol-9-yl-5,15-dioxa-1,24-diaza-16-boraheptacyclo[14.12.0.02,14.04,12.06,11.017,22.023,28]octacosa-2(14),3,6(11),7,9,12,17,19,21,23(28),24,26-dodecaene;25-carbazol-9-yl-5,15-dioxa-1,24-diaza-16-boraheptacyclo[14.12.0.02,14.04,12.06,11.017,22.023,28]octacosa-2(14),3,6,8,10,12,17,19,21,23(28),24,26-dodecaene;5-carbazol-9-yl-21-oxa-4,14-diaza-1-borapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-2,4,6,8,10,12,15,17,19-nonaene;10-carbazol-9-yl-21-oxa-4,14-diaza-1-borapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-2(7),3,5,8(13),9,11,15,17,19-nonaene;21-oxa-4,14-diaza-1-borapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-2(7),3,5,8,10,12,15,17,19-nonaene?
The canonical SMILES for 9-carbazol-9-yl-5,15-dioxa-1,24-diaza-16-boraheptacyclo[14.12.0.02,14.04,12.06,11.017,22.023,28]octacosa-2(14),3,6(11),7,9,12,17,19,21,23(28),24,26-dodecaene;25-carbazol-9-yl-5,15-dioxa-1,24-diaza-16-boraheptacyclo[14.12.0.02,14.04,12.06,11.017,22.023,28]octacosa-2(14),3,6,8,10,12,17,19,21,23(28),24,26-dodecaene;5-carbazol-9-yl-21-oxa-4,14-diaza-1-borapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-2,4,6,8,10,12,15,17,19-nonaene;10-carbazol-9-yl-21-oxa-4,14-diaza-1-borapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-2(7),3,5,8(13),9,11,15,17,19-nonaene;21-oxa-4,14-diaza-1-borapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-2(7),3,5,8,10,12,15,17,19-nonaene is c1ccc2c(c1)B1Oc3cc4c(cc3N1c1ccc(-n3c5ccccc5c5ccccc53)nc1-2)oc1ccccc14.c1ccc2c(c1)B1Oc3cc4c(cc3N1c1cccnc1-2)oc1ccc(-n2c3ccccc3c3ccccc32)cc14.c1ccc2c(c1)OB1c3cnc(-n4c5ccccc5c5ccccc54)cc3-c3ccccc3N12.c1ccc2c(c1)OB1c3cnccc3-c3cc(-n4c5ccccc5c5ccccc54)ccc3N12.c1ccc2c(c1)OB1c3cnccc3-c3ccccc3N12.
What is the InChIKey of 9-carbazol-9-yl-5,15-dioxa-1,24-diaza-16-boraheptacyclo[14.12.0.02,14.04,12.06,11.017,22.023,28]octacosa-2(14),3,6(11),7,9,12,17,19,21,23(28),24,26-dodecaene;25-carbazol-9-yl-5,15-dioxa-1,24-diaza-16-boraheptacyclo[14.12.0.02,14.04,12.06,11.017,22.023,28]octacosa-2(14),3,6,8,10,12,17,19,21,23(28),24,26-dodecaene;5-carbazol-9-yl-21-oxa-4,14-diaza-1-borapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-2,4,6,8,10,12,15,17,19-nonaene;10-carbazol-9-yl-21-oxa-4,14-diaza-1-borapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-2(7),3,5,8(13),9,11,15,17,19-nonaene;21-oxa-4,14-diaza-1-borapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-2(7),3,5,8,10,12,15,17,19-nonaene?
The InChIKey is YXRYLRFSFHXALL-UHFFFAOYSA-N. The full InChI is InChI=1S/2C35H20BN3O2.2C29H18BN3O.C17H11BN2O/c1-5-13-26-24(12-1)35-29(17-18-34(37-35)38-27-14-6-2-9-21(27)22-10-3-7-15-28(22)38)39-30-20-32-25(19-33(30)41-36(26)39)23-11-4-8-16-31(23)40-32;1-4-11-27-24(10-1)35-30(14-7-17-37-35)39-31-20-33-26(19-34(31)41-36(27)39)25-18-21(15-16-32(25)40-33)38-28-12-5-2-8-22(28)23-9-3-6-13-29(23)38;1-4-12-24-19(9-1)20-10-2-5-13-25(20)32(24)29-17-22-21-11-3-6-14-26(21)33-27-15-7-8-16-28(27)34-30(33)23(22)18-31-29;1-3-9-25-21(7-1)22-8-2-4-10-26(22)32(25)19-13-14-27-23(17-19)20-15-16-31-18-24(20)30-33(27)28-11-5-6-12-29(28)34-30;1-2-6-15-13(5-1)12-9-10-19-11-14(12)18-20(15)16-7-3-4-8-17(16)21-18/h2*1-20H;2*1-18H;1-11H.
What are the key properties of 9-carbazol-9-yl-5,15-dioxa-1,24-diaza-16-boraheptacyclo[14.12.0.02,14.04,12.06,11.017,22.023,28]octacosa-2(14),3,6(11),7,9,12,17,19,21,23(28),24,26-dodecaene;25-carbazol-9-yl-5,15-dioxa-1,24-diaza-16-boraheptacyclo[14.12.0.02,14.04,12.06,11.017,22.023,28]octacosa-2(14),3,6,8,10,12,17,19,21,23(28),24,26-dodecaene;5-carbazol-9-yl-21-oxa-4,14-diaza-1-borapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-2,4,6,8,10,12,15,17,19-nonaene;10-carbazol-9-yl-21-oxa-4,14-diaza-1-borapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-2(7),3,5,8(13),9,11,15,17,19-nonaene;21-oxa-4,14-diaza-1-borapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-2(7),3,5,8,10,12,15,17,19-nonaene?
9-carbazol-9-yl-5,15-dioxa-1,24-diaza-16-boraheptacyclo[14.12.0.02,14.04,12.06,11.017,22.023,28]octacosa-2(14),3,6(11),7,9,12,17,19,21,23(28),24,26-dodecaene;25-carbazol-9-yl-5,15-dioxa-1,24-diaza-16-boraheptacyclo[14.12.0.02,14.04,12.06,11.017,22.023,28]octacosa-2(14),3,6,8,10,12,17,19,21,23(28),24,26-dodecaene;5-carbazol-9-yl-21-oxa-4,14-diaza-1-borapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-2,4,6,8,10,12,15,17,19-nonaene;10-carbazol-9-yl-21-oxa-4,14-diaza-1-borapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-2(7),3,5,8(13),9,11,15,17,19-nonaene;21-oxa-4,14-diaza-1-borapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-2(7),3,5,8,10,12,15,17,19-nonaene has a molecular weight of 2191.44 g/mol, XLogP of 31.13, 4 rotatable bonds, 0 hydrogen bond donors, and 21 hydrogen bond acceptors.
Where does this data come from?
All data for 9-carbazol-9-yl-5,15-dioxa-1,24-diaza-16-boraheptacyclo[14.12.0.02,14.04,12.06,11.017,22.023,28]octacosa-2(14),3,6(11),7,9,12,17,19,21,23(28),24,26-dodecaene;25-carbazol-9-yl-5,15-dioxa-1,24-diaza-16-boraheptacyclo[14.12.0.02,14.04,12.06,11.017,22.023,28]octacosa-2(14),3,6,8,10,12,17,19,21,23(28),24,26-dodecaene;5-carbazol-9-yl-21-oxa-4,14-diaza-1-borapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-2,4,6,8,10,12,15,17,19-nonaene;10-carbazol-9-yl-21-oxa-4,14-diaza-1-borapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-2(7),3,5,8(13),9,11,15,17,19-nonaene;21-oxa-4,14-diaza-1-borapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-2(7),3,5,8,10,12,15,17,19-nonaene is sourced from PubChem (CID 162044453), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).