5,9-diphenyl-7-[4-(3-phenylphenyl)quinazolin-2-yl]benzo[c]carbazole;3-(9-phenylcarbazol-3-yl)-9-[3-(4-phenyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-2-yl)phenyl]carbazole

C97H65N7 — CID 159857779

IUPAC5,9-diphenyl-7-[4-(3-phenylphenyl)quinazolin-2-yl]benzo[c]carbazole;3-(9-phenylcarbazol-3-yl)-9-[3-(4-phenyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-2-yl)phenyl]carbazole
SMILESc1ccc(-c2cccc(-c3nc(-n4c5cc(-c6ccccc6)ccc5c5c6ccccc6c(-c6ccccc6)cc54)nc4ccccc34)c2)cc1.c1ccc(-c2nc(-c3cccc(-n4c5ccccc5c5cc(-c6ccc7c(c6)c6ccccc6n7-c6ccccc6)ccc54)c3)nc3c2CCC3)cc1
InChIInChI=1S/C49H34N4.C48H31N3/c1-3-13-32(14-4-1)48-40-21-12-22-43(40)50-49(51-48)35-15-11-18-37(29-35)53-45-24-10-8-20-39(45)42-31-34(26-28-47(42)53)33-25-27-46-41(30-33)38-19-7-9-23-44(38)52(46)36-16-5-2-6-17-36;1-4-15-32(16-5-1)35-21-14-22-37(29-35)47-40-25-12-13-26-43(40)49-48(50-47)51-44-30-36(33-17-6-2-7-18-33)27-28-41(44)46-39-24-11-10-23-38(39)42(31-45(46)51)34-19-8-3-9-20-34/h1-11,13-20,23-31H,12,21-22H2;1-31H
InChIKeyNQTBPWJHADMPPT-UHFFFAOYSA-N
MW1328.64 g/mol
LogP24.71
Rot. Bonds10

About 5,9-diphenyl-7-[4-(3-phenylphenyl)quinazolin-2-yl]benzo[c]carbazole;3-(9-phenylcarbazol-3-yl)-9-[3-(4-phenyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-2-yl)phenyl]carbazole

5,9-diphenyl-7-[4-(3-phenylphenyl)quinazolin-2-yl]benzo[c]carbazole;3-(9-phenylcarbazol-3-yl)-9-[3-(4-phenyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-2-yl)phenyl]carbazole (PubChem CID 159857779) has the molecular formula C97H65N7 and a molecular weight of 1328.64 g/mol. Its IUPAC name is 5,9-diphenyl-7-[4-(3-phenylphenyl)quinazolin-2-yl]benzo[c]carbazole;3-(9-phenylcarbazol-3-yl)-9-[3-(4-phenyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-2-yl)phenyl]carbazole.

Molecular Properties

Compound Name5,9-diphenyl-7-[4-(3-phenylphenyl)quinazolin-2-yl]benzo[c]carbazole;3-(9-phenylcarbazol-3-yl)-9-[3-(4-phenyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-2-yl)phenyl]carbazole
PubChem CID159857779
Molecular FormulaC97H65N7
Molecular Weight1328.64 g/mol
Exact Mass1327.53
IUPAC Name5,9-diphenyl-7-[4-(3-phenylphenyl)quinazolin-2-yl]benzo[c]carbazole;3-(9-phenylcarbazol-3-yl)-9-[3-(4-phenyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-2-yl)phenyl]carbazole
SMILESc1ccc(-c2cccc(-c3nc(-n4c5cc(-c6ccccc6)ccc5c5c6ccccc6c(-c6ccccc6)cc54)nc4ccccc34)c2)cc1.c1ccc(-c2nc(-c3cccc(-n4c5ccccc5c5cc(-c6ccc7c(c6)c6ccccc6n7-c6ccccc6)ccc54)c3)nc3c2CCC3)cc1
InChIInChI=1S/C49H34N4.C48H31N3/c1-3-13-32(14-4-1)48-40-21-12-22-43(40)50-49(51-48)35-15-11-18-37(29-35)53-45-24-10-8-20-39(45)42-31-34(26-28-47(42)53)33-25-27-46-41(30-33)38-19-7-9-23-44(38)52(46)36-16-5-2-6-17-36;1-4-15-32(16-5-1)35-21-14-22-37(29-35)47-40-25-12-13-26-43(40)49-48(50-47)51-44-30-36(33-17-6-2-7-18-33)27-28-41(44)46-39-24-11-10-23-38(39)42(31-45(46)51)34-19-8-3-9-20-34/h1-11,13-20,23-31H,12,21-22H2;1-31H
InChIKeyNQTBPWJHADMPPT-UHFFFAOYSA-N
XLogP24.71
TPSA66.35 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds10
Heavy Atoms104
Complexity

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001328.64
LogP ≤ 524.71
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

Analyze 5,9-diphenyl-7-[4-(3-phenylphenyl)quinazolin-2-yl]benzo[c]carbazole;3-(9-phenylcarbazol-3-yl)-9-[3-(4-phenyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-2-yl)phenyl]carbazole 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

Frequently Asked Questions

What is the IUPAC name of 5,9-diphenyl-7-[4-(3-phenylphenyl)quinazolin-2-yl]benzo[c]carbazole;3-(9-phenylcarbazol-3-yl)-9-[3-(4-phenyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-2-yl)phenyl]carbazole?
The IUPAC name of 5,9-diphenyl-7-[4-(3-phenylphenyl)quinazolin-2-yl]benzo[c]carbazole;3-(9-phenylcarbazol-3-yl)-9-[3-(4-phenyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-2-yl)phenyl]carbazole (CID 159857779) is 5,9-diphenyl-7-[4-(3-phenylphenyl)quinazolin-2-yl]benzo[c]carbazole;3-(9-phenylcarbazol-3-yl)-9-[3-(4-phenyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-2-yl)phenyl]carbazole.
What is the SMILES notation for 5,9-diphenyl-7-[4-(3-phenylphenyl)quinazolin-2-yl]benzo[c]carbazole;3-(9-phenylcarbazol-3-yl)-9-[3-(4-phenyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-2-yl)phenyl]carbazole?
The canonical SMILES for 5,9-diphenyl-7-[4-(3-phenylphenyl)quinazolin-2-yl]benzo[c]carbazole;3-(9-phenylcarbazol-3-yl)-9-[3-(4-phenyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-2-yl)phenyl]carbazole is c1ccc(-c2cccc(-c3nc(-n4c5cc(-c6ccccc6)ccc5c5c6ccccc6c(-c6ccccc6)cc54)nc4ccccc34)c2)cc1.c1ccc(-c2nc(-c3cccc(-n4c5ccccc5c5cc(-c6ccc7c(c6)c6ccccc6n7-c6ccccc6)ccc54)c3)nc3c2CCC3)cc1.
What is the InChIKey of 5,9-diphenyl-7-[4-(3-phenylphenyl)quinazolin-2-yl]benzo[c]carbazole;3-(9-phenylcarbazol-3-yl)-9-[3-(4-phenyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-2-yl)phenyl]carbazole?
The InChIKey is NQTBPWJHADMPPT-UHFFFAOYSA-N. The full InChI is InChI=1S/C49H34N4.C48H31N3/c1-3-13-32(14-4-1)48-40-21-12-22-43(40)50-49(51-48)35-15-11-18-37(29-35)53-45-24-10-8-20-39(45)42-31-34(26-28-47(42)53)33-25-27-46-41(30-33)38-19-7-9-23-44(38)52(46)36-16-5-2-6-17-36;1-4-15-32(16-5-1)35-21-14-22-37(29-35)47-40-25-12-13-26-43(40)49-48(50-47)51-44-30-36(33-17-6-2-7-18-33)27-28-41(44)46-39-24-11-10-23-38(39)42(31-45(46)51)34-19-8-3-9-20-34/h1-11,13-20,23-31H,12,21-22H2;1-31H.
What are the key properties of 5,9-diphenyl-7-[4-(3-phenylphenyl)quinazolin-2-yl]benzo[c]carbazole;3-(9-phenylcarbazol-3-yl)-9-[3-(4-phenyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-2-yl)phenyl]carbazole?
5,9-diphenyl-7-[4-(3-phenylphenyl)quinazolin-2-yl]benzo[c]carbazole;3-(9-phenylcarbazol-3-yl)-9-[3-(4-phenyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-2-yl)phenyl]carbazole has a molecular weight of 1328.64 g/mol, XLogP of 24.71, 10 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 5,9-diphenyl-7-[4-(3-phenylphenyl)quinazolin-2-yl]benzo[c]carbazole;3-(9-phenylcarbazol-3-yl)-9-[3-(4-phenyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-2-yl)phenyl]carbazole is sourced from PubChem (CID 159857779), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).