14-(6-carbazol-9-yl-2-pyridinyl)-3,24-diphenyl-3,12,13,15,24-pentazahexacyclo[15.7.0.02,10.04,9.011,16.018,23]tetracosa-1,4,6,8,10,12,14,16,18,20,22-undecaene

C48H29N7 — CID 137491094

IUPAC14-(6-carbazol-9-yl-2-pyridinyl)-3,24-diphenyl-3,12,13,15,24-pentazahexacyclo[15.7.0.02,10.04,9.011,16.018,23]tetracosa-1,4,6,8,10,12,14,16,18,20,22-undecaene
SMILESc1ccc(-n2c3ccccc3c3c4nnc(-c5cccc(-n6c7ccccc7c7ccccc76)n5)nc4c4c5ccccc5n(-c5ccccc5)c4c32)cc1
InChIInChI=1S/C48H29N7/c1-3-16-30(17-4-1)53-39-27-13-9-22-34(39)42-44-45(43-35-23-10-14-28-40(35)54(47(43)46(42)53)31-18-5-2-6-19-31)51-52-48(50-44)36-24-15-29-41(49-36)55-37-25-11-7-20-32(37)33-21-8-12-26-38(33)55/h1-29H
InChIKeyBQTRVSQERMAOGQ-UHFFFAOYSA-N
MW703.81 g/mol
LogP11.38
Rot. Bonds4

About 14-(6-carbazol-9-yl-2-pyridinyl)-3,24-diphenyl-3,12,13,15,24-pentazahexacyclo[15.7.0.02,10.04,9.011,16.018,23]tetracosa-1,4,6,8,10,12,14,16,18,20,22-undecaene

14-(6-carbazol-9-yl-2-pyridinyl)-3,24-diphenyl-3,12,13,15,24-pentazahexacyclo[15.7.0.02,10.04,9.011,16.018,23]tetracosa-1,4,6,8,10,12,14,16,18,20,22-undecaene (PubChem CID 137491094) has the molecular formula C48H29N7 and a molecular weight of 703.81 g/mol. Its IUPAC name is 14-(6-carbazol-9-yl-2-pyridinyl)-3,24-diphenyl-3,12,13,15,24-pentazahexacyclo[15.7.0.02,10.04,9.011,16.018,23]tetracosa-1,4,6,8,10,12,14,16,18,20,22-undecaene.

Molecular Properties

Compound Name14-(6-carbazol-9-yl-2-pyridinyl)-3,24-diphenyl-3,12,13,15,24-pentazahexacyclo[15.7.0.02,10.04,9.011,16.018,23]tetracosa-1,4,6,8,10,12,14,16,18,20,22-undecaene
PubChem CID137491094
Molecular FormulaC48H29N7
Molecular Weight703.81 g/mol
Exact Mass703.25
IUPAC Name14-(6-carbazol-9-yl-2-pyridinyl)-3,24-diphenyl-3,12,13,15,24-pentazahexacyclo[15.7.0.02,10.04,9.011,16.018,23]tetracosa-1,4,6,8,10,12,14,16,18,20,22-undecaene
SMILESc1ccc(-n2c3ccccc3c3c4nnc(-c5cccc(-n6c7ccccc7c7ccccc76)n5)nc4c4c5ccccc5n(-c5ccccc5)c4c32)cc1
InChIInChI=1S/C48H29N7/c1-3-16-30(17-4-1)53-39-27-13-9-22-34(39)42-44-45(43-35-23-10-14-28-40(35)54(47(43)46(42)53)31-18-5-2-6-19-31)51-52-48(50-44)36-24-15-29-41(49-36)55-37-25-11-7-20-32(37)33-21-8-12-26-38(33)55/h1-29H
InChIKeyBQTRVSQERMAOGQ-UHFFFAOYSA-N
XLogP11.38
TPSA66.35 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms55
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500703.81
LogP ≤ 511.38
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

Analyze 14-(6-carbazol-9-yl-2-pyridinyl)-3,24-diphenyl-3,12,13,15,24-pentazahexacyclo[15.7.0.02,10.04,9.011,16.018,23]tetracosa-1,4,6,8,10,12,14,16,18,20,22-undecaene with MolForge

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Related Compounds

9,13,24-triphenyl-9,12,14,15,24-pentazahexacyclo[15.7.0.02,10.03,8.011,16.018,23]tetracosa-1,3,5,7,10,12,14,16,18,20,22-undecaene
CID 137491100
9-[6-[6-(6-carbazol-9-yl-2-pyridinyl)-2-pyridinyl]-2-pyridinyl]carbazole
CID 118041251
9-[4-carbazol-9-yl-6-(6-carbazol-9-yl-2-pyridinyl)-1,3,5-triazin-2-yl]carbazole
CID 165047384
11-phenyl-12-[6-(4-phenylphenyl)-2-pyridinyl]indolo[2,3-a]carbazole
CID 134240187
14-naphthalen-2-yl-9,24-diphenyl-9,12,13,15,24-pentazahexacyclo[15.7.0.02,10.03,8.011,16.018,23]tetracosa-1,3,5,7,10,12,14,16,18,20,22-undecaene
CID 167366025
5-phenyl-11-(6-phenyl-2-pyridinyl)indolo[3,2-b]carbazole
CID 58570053
5,12-bis(4-phenylphenyl)indolo[3,2-c]carbazole;12-phenyl-5-(4-phenylphenyl)indolo[3,2-c]carbazole;5-(4-phenylphenyl)-12-(6-phenyl-2-pyridinyl)indolo[3,2-c]carbazole
CID 158271663
12-(6-carbazol-9-yl-2-pyridinyl)-11-[3-(11-phenylindolo[2,3-a]carbazol-12-yl)phenyl]indolo[2,3-a]carbazole
CID 118041124
12-[6-(6-carbazol-9-yl-2-pyridinyl)-2-pyridinyl]-11-(3-phenylphenyl)indolo[2,3-a]carbazole
CID 58570101
12-(6-carbazol-9-yl-2-pyridinyl)-11-[6-(6-carbazol-9-yl-2-pyridinyl)-2-pyridinyl]indolo[2,3-a]carbazole
CID 58038308
6-(11-phenylindolo[2,3-a]carbazol-12-yl)pyridine-2-carbonitrile
CID 144595820
5-phenyl-12-[3-(12-phenylindolo[3,2-c]carbazol-5-yl)phenyl]indolo[3,2-c]carbazole;5-phenyl-12-[4-(12-phenylindolo[3,2-c]carbazol-5-yl)phenyl]indolo[3,2-c]carbazole;5-phenyl-12-[4-[4-(12-phenylindolo[3,2-c]carbazol-5-yl)phenyl]phenyl]indolo[3,2-c]carbazole;5-phenyl-12-[3-[12-(3-phenylphenyl)indolo[3,2-c]carbazol-5-yl]phenyl]indolo[3,2-c]carbazole;12-phenyl-5-[3-[5-(6-phenyl-2-pyridinyl)indolo[3,2-c]carbazol-12-yl]phenyl]indolo[3,2-c]carbazole;5-(6-phenyl-2-pyridinyl)-12-[3-[12-(6-phenyl-2-pyridinyl)indolo[3,2-c]carbazol-5-yl]phenyl]indolo[3,2-c]carbazole
CID 160727594

Frequently Asked Questions

What is the IUPAC name of 14-(6-carbazol-9-yl-2-pyridinyl)-3,24-diphenyl-3,12,13,15,24-pentazahexacyclo[15.7.0.02,10.04,9.011,16.018,23]tetracosa-1,4,6,8,10,12,14,16,18,20,22-undecaene?
The IUPAC name of 14-(6-carbazol-9-yl-2-pyridinyl)-3,24-diphenyl-3,12,13,15,24-pentazahexacyclo[15.7.0.02,10.04,9.011,16.018,23]tetracosa-1,4,6,8,10,12,14,16,18,20,22-undecaene (CID 137491094) is 14-(6-carbazol-9-yl-2-pyridinyl)-3,24-diphenyl-3,12,13,15,24-pentazahexacyclo[15.7.0.02,10.04,9.011,16.018,23]tetracosa-1,4,6,8,10,12,14,16,18,20,22-undecaene.
What is the SMILES notation for 14-(6-carbazol-9-yl-2-pyridinyl)-3,24-diphenyl-3,12,13,15,24-pentazahexacyclo[15.7.0.02,10.04,9.011,16.018,23]tetracosa-1,4,6,8,10,12,14,16,18,20,22-undecaene?
The canonical SMILES for 14-(6-carbazol-9-yl-2-pyridinyl)-3,24-diphenyl-3,12,13,15,24-pentazahexacyclo[15.7.0.02,10.04,9.011,16.018,23]tetracosa-1,4,6,8,10,12,14,16,18,20,22-undecaene is c1ccc(-n2c3ccccc3c3c4nnc(-c5cccc(-n6c7ccccc7c7ccccc76)n5)nc4c4c5ccccc5n(-c5ccccc5)c4c32)cc1.
What is the InChIKey of 14-(6-carbazol-9-yl-2-pyridinyl)-3,24-diphenyl-3,12,13,15,24-pentazahexacyclo[15.7.0.02,10.04,9.011,16.018,23]tetracosa-1,4,6,8,10,12,14,16,18,20,22-undecaene?
The InChIKey is BQTRVSQERMAOGQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C48H29N7/c1-3-16-30(17-4-1)53-39-27-13-9-22-34(39)42-44-45(43-35-23-10-14-28-40(35)54(47(43)46(42)53)31-18-5-2-6-19-31)51-52-48(50-44)36-24-15-29-41(49-36)55-37-25-11-7-20-32(37)33-21-8-12-26-38(33)55/h1-29H.
What are the key properties of 14-(6-carbazol-9-yl-2-pyridinyl)-3,24-diphenyl-3,12,13,15,24-pentazahexacyclo[15.7.0.02,10.04,9.011,16.018,23]tetracosa-1,4,6,8,10,12,14,16,18,20,22-undecaene?
14-(6-carbazol-9-yl-2-pyridinyl)-3,24-diphenyl-3,12,13,15,24-pentazahexacyclo[15.7.0.02,10.04,9.011,16.018,23]tetracosa-1,4,6,8,10,12,14,16,18,20,22-undecaene has a molecular weight of 703.81 g/mol, XLogP of 11.38, 4 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 14-(6-carbazol-9-yl-2-pyridinyl)-3,24-diphenyl-3,12,13,15,24-pentazahexacyclo[15.7.0.02,10.04,9.011,16.018,23]tetracosa-1,4,6,8,10,12,14,16,18,20,22-undecaene is sourced from PubChem (CID 137491094), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).