3,10-bis[4-(9,9-diphenylacridin-10-yl)phenyl]-14-phenyl-2,4,5,8,9,11-hexazatetracyclo[10.4.0.02,6.07,11]hexadeca-1(12),3,5,7,9,13,15-heptaene

C78H52N8 — CID 130399490

IUPAC3,10-bis[4-(9,9-diphenylacridin-10-yl)phenyl]-14-phenyl-2,4,5,8,9,11-hexazatetracyclo[10.4.0.02,6.07,11]hexadeca-1(12),3,5,7,9,13,15-heptaene
SMILESc1ccc(-c2ccc3c(c2)n2c(-c4ccc(N5c6ccccc6C(c6ccccc6)(c6ccccc6)c6ccccc65)cc4)nnc2c2nnc(-c4ccc(N5c6ccccc6C(c6ccccc6)(c6ccccc6)c6ccccc65)cc4)n32)cc1
InChIInChI=1S/C78H52N8/c1-6-24-53(25-7-1)56-46-51-71-72(52-56)86-74(55-44-49-62(50-45-55)84-69-40-22-18-36-65(69)78(59-30-12-4-13-31-59,60-32-14-5-15-33-60)66-37-19-23-41-70(66)84)80-82-76(86)75-81-79-73(85(71)75)54-42-47-61(48-43-54)83-67-38-20-16-34-63(67)77(57-26-8-2-9-27-57,58-28-10-3-11-29-58)64-35-17-21-39-68(64)83/h1-52H
InChIKeyAJLRYEAVVGODQV-UHFFFAOYSA-N
MW1101.33 g/mol
LogP18.26
Rot. Bonds9

About 3,10-bis[4-(9,9-diphenylacridin-10-yl)phenyl]-14-phenyl-2,4,5,8,9,11-hexazatetracyclo[10.4.0.02,6.07,11]hexadeca-1(12),3,5,7,9,13,15-heptaene

3,10-bis[4-(9,9-diphenylacridin-10-yl)phenyl]-14-phenyl-2,4,5,8,9,11-hexazatetracyclo[10.4.0.02,6.07,11]hexadeca-1(12),3,5,7,9,13,15-heptaene (PubChem CID 130399490) has the molecular formula C78H52N8 and a molecular weight of 1101.33 g/mol. Its IUPAC name is 3,10-bis[4-(9,9-diphenylacridin-10-yl)phenyl]-14-phenyl-2,4,5,8,9,11-hexazatetracyclo[10.4.0.02,6.07,11]hexadeca-1(12),3,5,7,9,13,15-heptaene.

Molecular Properties

Compound Name3,10-bis[4-(9,9-diphenylacridin-10-yl)phenyl]-14-phenyl-2,4,5,8,9,11-hexazatetracyclo[10.4.0.02,6.07,11]hexadeca-1(12),3,5,7,9,13,15-heptaene
PubChem CID130399490
Molecular FormulaC78H52N8
Molecular Weight1101.33 g/mol
Exact Mass1100.43
IUPAC Name3,10-bis[4-(9,9-diphenylacridin-10-yl)phenyl]-14-phenyl-2,4,5,8,9,11-hexazatetracyclo[10.4.0.02,6.07,11]hexadeca-1(12),3,5,7,9,13,15-heptaene
SMILESc1ccc(-c2ccc3c(c2)n2c(-c4ccc(N5c6ccccc6C(c6ccccc6)(c6ccccc6)c6ccccc65)cc4)nnc2c2nnc(-c4ccc(N5c6ccccc6C(c6ccccc6)(c6ccccc6)c6ccccc65)cc4)n32)cc1
InChIInChI=1S/C78H52N8/c1-6-24-53(25-7-1)56-46-51-71-72(52-56)86-74(55-44-49-62(50-45-55)84-69-40-22-18-36-65(69)78(59-30-12-4-13-31-59,60-32-14-5-15-33-60)66-37-19-23-41-70(66)84)80-82-76(86)75-81-79-73(85(71)75)54-42-47-61(48-43-54)83-67-38-20-16-34-63(67)77(57-26-8-2-9-27-57,58-28-10-3-11-29-58)64-35-17-21-39-68(64)83/h1-52H
InChIKeyAJLRYEAVVGODQV-UHFFFAOYSA-N
XLogP18.26
TPSA66.86 Ų
H-Bond Donors
H-Bond Acceptors8
Rotatable Bonds9
Heavy Atoms86
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001101.33
LogP ≤ 518.26
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 108

Analyze 3,10-bis[4-(9,9-diphenylacridin-10-yl)phenyl]-14-phenyl-2,4,5,8,9,11-hexazatetracyclo[10.4.0.02,6.07,11]hexadeca-1(12),3,5,7,9,13,15-heptaene 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

10-[4-[10-[4-(9,9-diphenylacridin-10-yl)phenyl]-2,4,5,8,9,11-hexazatetracyclo[10.4.0.02,6.07,11]hexadeca-1(16),3,5,7,9,12,14-heptaen-3-yl]phenyl]phenoxazine
CID 130399498
3-[4-(9,9-diphenylacridin-10-yl)phenyl]-2,4,5,8,9,11-hexazatetracyclo[10.4.0.02,6.07,11]hexadeca-1(16),3,5,7,9,12,14-heptaene
CID 130399482
10-[4-[3-[3-[4-(9,9-diphenylacridin-10-yl)phenyl]phenyl]phenyl]phenyl]-9,9-diphenylacridine
CID 59470076
10-[4-(9,9-diphenylacridin-10-yl)phenyl]-9,9-diphenylacridine
CID 59399598
9-phenyl-9-(9-phenylcarbazol-3-yl)-10-[4-(9-phenylcarbazol-3-yl)phenyl]acridine
CID 146511276
2-phenyl-10,10'-bis(4-phenylphenyl)-9,9'-spirobi[acridine]
CID 118465104
N,4-diphenyl-N-[4-(9,9,10-triphenylacridin-3-yl)phenyl]aniline
CID 121259178
2-methyl-10-(4-methylphenyl)-9,9-diphenylacridine
CID 58029188
10-[4-(9,10-diphenylacridin-9-yl)phenyl]-2,7-dimethyl-9,9-diphenylacridine
CID 135226075
3-(3-bromophenyl)-9,9,10-triphenylacridine
CID 121259219
14-[4-(9,9-diphenylacridin-10-yl)phenyl]-15-(4-phenylphenyl)-4,9-dithia-3,5,8,10,13,16-hexazatetracyclo[10.4.0.02,6.07,11]hexadeca-1(12),2,5,7,10,13,15-heptaene
CID 144918593
9,9-diphenyl-10-[4-[9-[4-(4-phenylquinazolin-2-yl)phenyl]carbazol-3-yl]phenyl]acridine
CID 163970160

Frequently Asked Questions

What is the IUPAC name of 3,10-bis[4-(9,9-diphenylacridin-10-yl)phenyl]-14-phenyl-2,4,5,8,9,11-hexazatetracyclo[10.4.0.02,6.07,11]hexadeca-1(12),3,5,7,9,13,15-heptaene?
The IUPAC name of 3,10-bis[4-(9,9-diphenylacridin-10-yl)phenyl]-14-phenyl-2,4,5,8,9,11-hexazatetracyclo[10.4.0.02,6.07,11]hexadeca-1(12),3,5,7,9,13,15-heptaene (CID 130399490) is 3,10-bis[4-(9,9-diphenylacridin-10-yl)phenyl]-14-phenyl-2,4,5,8,9,11-hexazatetracyclo[10.4.0.02,6.07,11]hexadeca-1(12),3,5,7,9,13,15-heptaene.
What is the SMILES notation for 3,10-bis[4-(9,9-diphenylacridin-10-yl)phenyl]-14-phenyl-2,4,5,8,9,11-hexazatetracyclo[10.4.0.02,6.07,11]hexadeca-1(12),3,5,7,9,13,15-heptaene?
The canonical SMILES for 3,10-bis[4-(9,9-diphenylacridin-10-yl)phenyl]-14-phenyl-2,4,5,8,9,11-hexazatetracyclo[10.4.0.02,6.07,11]hexadeca-1(12),3,5,7,9,13,15-heptaene is c1ccc(-c2ccc3c(c2)n2c(-c4ccc(N5c6ccccc6C(c6ccccc6)(c6ccccc6)c6ccccc65)cc4)nnc2c2nnc(-c4ccc(N5c6ccccc6C(c6ccccc6)(c6ccccc6)c6ccccc65)cc4)n32)cc1.
What is the InChIKey of 3,10-bis[4-(9,9-diphenylacridin-10-yl)phenyl]-14-phenyl-2,4,5,8,9,11-hexazatetracyclo[10.4.0.02,6.07,11]hexadeca-1(12),3,5,7,9,13,15-heptaene?
The InChIKey is AJLRYEAVVGODQV-UHFFFAOYSA-N. The full InChI is InChI=1S/C78H52N8/c1-6-24-53(25-7-1)56-46-51-71-72(52-56)86-74(55-44-49-62(50-45-55)84-69-40-22-18-36-65(69)78(59-30-12-4-13-31-59,60-32-14-5-15-33-60)66-37-19-23-41-70(66)84)80-82-76(86)75-81-79-73(85(71)75)54-42-47-61(48-43-54)83-67-38-20-16-34-63(67)77(57-26-8-2-9-27-57,58-28-10-3-11-29-58)64-35-17-21-39-68(64)83/h1-52H.
What are the key properties of 3,10-bis[4-(9,9-diphenylacridin-10-yl)phenyl]-14-phenyl-2,4,5,8,9,11-hexazatetracyclo[10.4.0.02,6.07,11]hexadeca-1(12),3,5,7,9,13,15-heptaene?
3,10-bis[4-(9,9-diphenylacridin-10-yl)phenyl]-14-phenyl-2,4,5,8,9,11-hexazatetracyclo[10.4.0.02,6.07,11]hexadeca-1(12),3,5,7,9,13,15-heptaene has a molecular weight of 1101.33 g/mol, XLogP of 18.26, 9 rotatable bonds, 0 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 3,10-bis[4-(9,9-diphenylacridin-10-yl)phenyl]-14-phenyl-2,4,5,8,9,11-hexazatetracyclo[10.4.0.02,6.07,11]hexadeca-1(12),3,5,7,9,13,15-heptaene is sourced from PubChem (CID 130399490), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).