6-(3-dibenzofuran-2-ylphenyl)-24-(10-phenyl-9H-acridin-2-yl)-15-oxa-6,24-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

C61H37N3O2 — CID 153295121

IUPAC6-(3-dibenzofuran-2-ylphenyl)-24-(10-phenyl-9H-acridin-2-yl)-15-oxa-6,24-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
SMILESc1ccc(N2c3ccccc3Cc3cc(-n4c5ccccc5c5c6oc7c(ccc8c7c7ccccc7n8-c7cccc(-c8ccc9oc%10ccccc%10c9c8)c7)c6ccc54)ccc32)cc1
InChIInChI=1S/C61H37N3O2/c1-2-15-41(16-3-1)62-50-21-8-4-13-39(50)33-40-35-43(26-29-51(40)62)64-53-23-10-6-20-48(53)59-55(64)31-28-46-45-27-30-54-58(60(45)66-61(46)59)47-19-5-9-22-52(47)63(54)42-17-12-14-37(34-42)38-25-32-57-49(36-38)44-18-7-11-24-56(44)65-57/h1-32,34-36H,33H2
InChIKeyAKKGVVMFILFHEQ-UHFFFAOYSA-N
MW843.99 g/mol
LogP16.72
Rot. Bonds4

About 6-(3-dibenzofuran-2-ylphenyl)-24-(10-phenyl-9H-acridin-2-yl)-15-oxa-6,24-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

6-(3-dibenzofuran-2-ylphenyl)-24-(10-phenyl-9H-acridin-2-yl)-15-oxa-6,24-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 (PubChem CID 153295121) has the molecular formula C61H37N3O2 and a molecular weight of 843.99 g/mol. Its IUPAC name is 6-(3-dibenzofuran-2-ylphenyl)-24-(10-phenyl-9H-acridin-2-yl)-15-oxa-6,24-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.

Molecular Properties

Compound Name6-(3-dibenzofuran-2-ylphenyl)-24-(10-phenyl-9H-acridin-2-yl)-15-oxa-6,24-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
PubChem CID153295121
Molecular FormulaC61H37N3O2
Molecular Weight843.99 g/mol
Exact Mass843.29
IUPAC Name6-(3-dibenzofuran-2-ylphenyl)-24-(10-phenyl-9H-acridin-2-yl)-15-oxa-6,24-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
SMILESc1ccc(N2c3ccccc3Cc3cc(-n4c5ccccc5c5c6oc7c(ccc8c7c7ccccc7n8-c7cccc(-c8ccc9oc%10ccccc%10c9c8)c7)c6ccc54)ccc32)cc1
InChIInChI=1S/C61H37N3O2/c1-2-15-41(16-3-1)62-50-21-8-4-13-39(50)33-40-35-43(26-29-51(40)62)64-53-23-10-6-20-48(53)59-55(64)31-28-46-45-27-30-54-58(60(45)66-61(46)59)47-19-5-9-22-52(47)63(54)42-17-12-14-37(34-42)38-25-32-57-49(36-38)44-18-7-11-24-56(44)65-57/h1-32,34-36H,33H2
InChIKeyAKKGVVMFILFHEQ-UHFFFAOYSA-N
XLogP16.72
TPSA39.38 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms66
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500843.99
LogP ≤ 516.72
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze 6-(3-dibenzofuran-2-ylphenyl)-24-(10-phenyl-9H-acridin-2-yl)-15-oxa-6,24-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 with MolForge

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Related Compounds

6-(4-dibenzofuran-2-ylphenyl)-24-phenyl-15-oxa-6,24-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;ethane
CID 144604260
5-(7-dibenzofuran-2-yldibenzofuran-2-yl)-[1]benzofuro[3,2-c]carbazole
CID 170276888
5-[3,5-di(dibenzofuran-2-yl)phenyl]-[1]benzofuro[3,2-c]carbazole
CID 171612138
6,24-bis(9,9-dimethylfluoren-2-yl)-15-oxa-6,24-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;6-(3-dibenzofuran-2-ylphenyl)-24-phenyl-15-oxa-6,24-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;6-(9-phenylcarbazol-3-yl)-24-(10-phenyl-9,10-dihydroanthracen-2-yl)-15-oxa-6,24-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 158306278
5-phenyl-9-[3-(9-phenylcarbazol-3-yl)carbazol-9-yl]-[1]benzofuro[3,2-c]carbazole
CID 137401801
9-dibenzofuran-2-yl-14-[3-(3-phenylphenyl)phenyl]-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene
CID 166961355
3-(9-dibenzofuran-2-ylcarbazol-3-yl)-9-[3-(3,5-diphenylphenyl)phenyl]-6-phenylcarbazole
CID 129265423
5-[4-[4-(3-phenylcarbazol-9-yl)phenyl]phenyl]-[1]benzofuro[3,2-c]carbazole
CID 167193138
6-dibenzofuran-2-yl-24-(5,6-dihydronaphthalen-1-yl)-15-oxa-6,24-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;ethane
CID 144604354
3-(9-dibenzofuran-2-ylcarbazol-3-yl)-9-(3-phenylphenyl)carbazole
CID 90350922
2-(9,14-diphenyl-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3(8),4,6,11,15,17,19-nonaen-5-yl)-5-phenyl-[1]benzofuro[3,2-c]carbazole
CID 134223669
3-(9-dibenzofuran-2-ylcarbazol-3-yl)-6-phenyl-9-(3-phenylphenyl)carbazole
CID 170072680

Frequently Asked Questions

What is the IUPAC name of 6-(3-dibenzofuran-2-ylphenyl)-24-(10-phenyl-9H-acridin-2-yl)-15-oxa-6,24-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?
The IUPAC name of 6-(3-dibenzofuran-2-ylphenyl)-24-(10-phenyl-9H-acridin-2-yl)-15-oxa-6,24-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 153295121) is 6-(3-dibenzofuran-2-ylphenyl)-24-(10-phenyl-9H-acridin-2-yl)-15-oxa-6,24-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.
What is the SMILES notation for 6-(3-dibenzofuran-2-ylphenyl)-24-(10-phenyl-9H-acridin-2-yl)-15-oxa-6,24-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?
The canonical SMILES for 6-(3-dibenzofuran-2-ylphenyl)-24-(10-phenyl-9H-acridin-2-yl)-15-oxa-6,24-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 is c1ccc(N2c3ccccc3Cc3cc(-n4c5ccccc5c5c6oc7c(ccc8c7c7ccccc7n8-c7cccc(-c8ccc9oc%10ccccc%10c9c8)c7)c6ccc54)ccc32)cc1.
What is the InChIKey of 6-(3-dibenzofuran-2-ylphenyl)-24-(10-phenyl-9H-acridin-2-yl)-15-oxa-6,24-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?
The InChIKey is AKKGVVMFILFHEQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C61H37N3O2/c1-2-15-41(16-3-1)62-50-21-8-4-13-39(50)33-40-35-43(26-29-51(40)62)64-53-23-10-6-20-48(53)59-55(64)31-28-46-45-27-30-54-58(60(45)66-61(46)59)47-19-5-9-22-52(47)63(54)42-17-12-14-37(34-42)38-25-32-57-49(36-38)44-18-7-11-24-56(44)65-57/h1-32,34-36H,33H2.
What are the key properties of 6-(3-dibenzofuran-2-ylphenyl)-24-(10-phenyl-9H-acridin-2-yl)-15-oxa-6,24-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?
6-(3-dibenzofuran-2-ylphenyl)-24-(10-phenyl-9H-acridin-2-yl)-15-oxa-6,24-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 has a molecular weight of 843.99 g/mol, XLogP of 16.72, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(3-dibenzofuran-2-ylphenyl)-24-(10-phenyl-9H-acridin-2-yl)-15-oxa-6,24-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 is sourced from PubChem (CID 153295121), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).