10-phenyl-3,6-bis(pyrido[2,3-b]indol-9-yl)spiro[acridine-9,9'-fluorene]

C53H33N5 — CID 122367920

IUPAC10-phenyl-3,6-bis(pyrido[2,3-b]indol-9-yl)spiro[acridine-9,9'-fluorene]
SMILESc1ccc(N2c3cc(-n4c5ccccc5c5cccnc54)ccc3C3(c4ccccc4-c4ccccc43)c3ccc(-n4c5ccccc5c5cccnc54)cc32)cc1
InChIInChI=1S/C53H33N5/c1-2-14-34(15-3-1)56-49-32-35(57-47-24-10-6-18-39(47)41-20-12-30-54-51(41)57)26-28-45(49)53(43-22-8-4-16-37(43)38-17-5-9-23-44(38)53)46-29-27-36(33-50(46)56)58-48-25-11-7-19-40(48)42-21-13-31-55-52(42)58/h1-33H
InChIKeySDBNVEAWXPDVOS-UHFFFAOYSA-N
MW739.88 g/mol
LogP12.82
Rot. Bonds3

About 10-phenyl-3,6-bis(pyrido[2,3-b]indol-9-yl)spiro[acridine-9,9'-fluorene]

10-phenyl-3,6-bis(pyrido[2,3-b]indol-9-yl)spiro[acridine-9,9'-fluorene] (PubChem CID 122367920) has the molecular formula C53H33N5 and a molecular weight of 739.88 g/mol. Its IUPAC name is 10-phenyl-3,6-bis(pyrido[2,3-b]indol-9-yl)spiro[acridine-9,9'-fluorene].

Molecular Properties

Compound Name10-phenyl-3,6-bis(pyrido[2,3-b]indol-9-yl)spiro[acridine-9,9'-fluorene]
PubChem CID122367920
Molecular FormulaC53H33N5
Molecular Weight739.88 g/mol
Exact Mass739.27
IUPAC Name10-phenyl-3,6-bis(pyrido[2,3-b]indol-9-yl)spiro[acridine-9,9'-fluorene]
SMILESc1ccc(N2c3cc(-n4c5ccccc5c5cccnc54)ccc3C3(c4ccccc4-c4ccccc43)c3ccc(-n4c5ccccc5c5cccnc54)cc32)cc1
InChIInChI=1S/C53H33N5/c1-2-14-34(15-3-1)56-49-32-35(57-47-24-10-6-18-39(47)41-20-12-30-54-51(41)57)26-28-45(49)53(43-22-8-4-16-37(43)38-17-5-9-23-44(38)53)46-29-27-36(33-50(46)56)58-48-25-11-7-19-40(48)42-21-13-31-55-52(42)58/h1-33H
InChIKeySDBNVEAWXPDVOS-UHFFFAOYSA-N
XLogP12.82
TPSA38.88 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms58
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500739.88
LogP ≤ 512.82
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze 10-phenyl-3,6-bis(pyrido[2,3-b]indol-9-yl)spiro[acridine-9,9'-fluorene] with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

3,6-di(carbazol-9-yl)-10-phenylspiro[acridine-9,9'-fluorene]
CID 122367921
14-phenyl-25-pyrido[2,3-b]indol-9-yl-14,21-diazaheptacyclo[19.10.1.02,7.08,13.015,20.022,27.028,32]dotriaconta-1(31),2,4,6,8,10,12,15,17,19,22(27),23,25,28(32),29-pentadecaene
CID 177285265
9-phenylpyrido[2,3-b]indole
CID 15939260
6-(3-carbazol-9-ylcarbazol-9-yl)-9-phenylpyrido[2,3-b]indole
CID 168845228
6-pyrido[2,3-b]indol-9-yl-9-tetraphenylen-2-ylpyrido[2,3-b]indole
CID 137095996
10-phenyl-3'-[9-(4-phenylphenyl)carbazol-3-yl]spiro[acridine-9,9'-fluorene]
CID 163947918
10-(4,6-diphenyl-1,3,5-triazin-2-yl)-21-phenylspiro[10,21-diazapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(13),2,4,6,8,11,15,17,19-nonaene-14,9'-fluorene]
CID 66804868
10-pyrido[2,3-b]indol-9-yl-3,24-diazapentacyclo[18.4.0.02,7.08,13.014,19]tetracosa-1(20),2(7),3,5,8(13),9,11,14,16,18,21,23-dodecaene
CID 140920315
9-(8-pyrido[2,3-b]indol-9-yldibenzothiophen-2-yl)pyrido[2,3-b]indole
CID 132568147
3-[4-[3,6-di(carbazol-9-yl)spiro[acridine-9,9'-fluorene]-10-yl]phenyl]-10,10-dimethylanthracen-9-one
CID 142288083
10-(5-pyridin-3-ylpyrido[3,2-b]indol-8-yl)spiro[acridine-9,9'-fluorene]
CID 138641297
3-carbazol-9-yl-N-phenyl-N-(3-pyrido[2,3-b]indol-9-ylphenyl)aniline
CID 140680686

Frequently Asked Questions

What is the IUPAC name of 10-phenyl-3,6-bis(pyrido[2,3-b]indol-9-yl)spiro[acridine-9,9'-fluorene]?
The IUPAC name of 10-phenyl-3,6-bis(pyrido[2,3-b]indol-9-yl)spiro[acridine-9,9'-fluorene] (CID 122367920) is 10-phenyl-3,6-bis(pyrido[2,3-b]indol-9-yl)spiro[acridine-9,9'-fluorene].
What is the SMILES notation for 10-phenyl-3,6-bis(pyrido[2,3-b]indol-9-yl)spiro[acridine-9,9'-fluorene]?
The canonical SMILES for 10-phenyl-3,6-bis(pyrido[2,3-b]indol-9-yl)spiro[acridine-9,9'-fluorene] is c1ccc(N2c3cc(-n4c5ccccc5c5cccnc54)ccc3C3(c4ccccc4-c4ccccc43)c3ccc(-n4c5ccccc5c5cccnc54)cc32)cc1.
What is the InChIKey of 10-phenyl-3,6-bis(pyrido[2,3-b]indol-9-yl)spiro[acridine-9,9'-fluorene]?
The InChIKey is SDBNVEAWXPDVOS-UHFFFAOYSA-N. The full InChI is InChI=1S/C53H33N5/c1-2-14-34(15-3-1)56-49-32-35(57-47-24-10-6-18-39(47)41-20-12-30-54-51(41)57)26-28-45(49)53(43-22-8-4-16-37(43)38-17-5-9-23-44(38)53)46-29-27-36(33-50(46)56)58-48-25-11-7-19-40(48)42-21-13-31-55-52(42)58/h1-33H.
What are the key properties of 10-phenyl-3,6-bis(pyrido[2,3-b]indol-9-yl)spiro[acridine-9,9'-fluorene]?
10-phenyl-3,6-bis(pyrido[2,3-b]indol-9-yl)spiro[acridine-9,9'-fluorene] has a molecular weight of 739.88 g/mol, XLogP of 12.82, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 10-phenyl-3,6-bis(pyrido[2,3-b]indol-9-yl)spiro[acridine-9,9'-fluorene] is sourced from PubChem (CID 122367920), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).