6-[3-(9H-acridin-10-yl)carbazol-9-yl]benzimidazolo[1,2-c]quinazoline

C39H25N5 — CID 145199154

IUPAC6-[3-(9H-acridin-10-yl)carbazol-9-yl]benzimidazolo[1,2-c]quinazoline
SMILESc1ccc2c(c1)Cc1ccccc1N2c1ccc2c(c1)c1ccccc1n2-c1nc2ccccc2c2nc3ccccc3n12
InChIInChI=1S/C39H25N5/c1-7-17-33-25(11-1)23-26-12-2-8-18-34(26)42(33)27-21-22-36-30(24-27)28-13-4-9-19-35(28)43(36)39-41-31-15-5-3-14-29(31)38-40-32-16-6-10-20-37(32)44(38)39/h1-22,24H,23H2
InChIKeyDLHUVQNVKDDJNC-UHFFFAOYSA-N
MW563.66 g/mol
LogP9.51
Rot. Bonds2

About 6-[3-(9H-acridin-10-yl)carbazol-9-yl]benzimidazolo[1,2-c]quinazoline

6-[3-(9H-acridin-10-yl)carbazol-9-yl]benzimidazolo[1,2-c]quinazoline (PubChem CID 145199154) has the molecular formula C39H25N5 and a molecular weight of 563.66 g/mol. Its IUPAC name is 6-[3-(9H-acridin-10-yl)carbazol-9-yl]benzimidazolo[1,2-c]quinazoline.

Molecular Properties

Compound Name6-[3-(9H-acridin-10-yl)carbazol-9-yl]benzimidazolo[1,2-c]quinazoline
PubChem CID145199154
Molecular FormulaC39H25N5
Molecular Weight563.66 g/mol
Exact Mass563.21
IUPAC Name6-[3-(9H-acridin-10-yl)carbazol-9-yl]benzimidazolo[1,2-c]quinazoline
SMILESc1ccc2c(c1)Cc1ccccc1N2c1ccc2c(c1)c1ccccc1n2-c1nc2ccccc2c2nc3ccccc3n12
InChIInChI=1S/C39H25N5/c1-7-17-33-25(11-1)23-26-12-2-8-18-34(26)42(33)27-21-22-36-30(24-27)28-13-4-9-19-35(28)43(36)39-41-31-15-5-3-14-29(31)38-40-32-16-6-10-20-37(32)44(38)39/h1-22,24H,23H2
InChIKeyDLHUVQNVKDDJNC-UHFFFAOYSA-N
XLogP9.51
TPSA38.36 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms44
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500563.66
LogP ≤ 59.51
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

6-[3-(4-carbazol-9-ylphenyl)carbazol-9-yl]benzimidazolo[1,2-c]quinazoline
CID 134508650
6-[3-[4-(9-phenylcarbazol-3-yl)phenyl]carbazol-9-yl]benzimidazolo[1,2-c]quinazoline
CID 134508649
6-[3-(4-pyridin-4-ylphenyl)carbazol-9-yl]benzimidazolo[1,2-c]quinazoline
CID 134508747
6-[3-(4-carbazol-9-ylphenyl)carbazol-9-yl]benzimidazolo[1,2-c]quinazoline;6-[3-[9-(4-phenylphenyl)carbazol-2-yl]carbazol-9-yl]benzimidazolo[1,2-c]quinazoline;6-[3-[9-(4-phenylphenyl)carbazol-3-yl]carbazol-9-yl]benzimidazolo[1,2-c]quinazoline
CID 158963688
6-(3-naphthalen-2-ylcarbazol-9-yl)benzimidazolo[1,2-c]quinazoline
CID 134508704
6-(3-benzo[a]carbazol-11-ylcarbazol-9-yl)benzimidazolo[1,2-c]quinazoline;6-(3-benzo[c]carbazol-7-ylcarbazol-9-yl)benzimidazolo[1,2-c]quinazoline;6-(3-carbazol-9-ylcarbazol-9-yl)benzimidazolo[1,2-c]quinazoline
CID 159283423
6-[3-(9-naphthalen-2-ylcarbazol-2-yl)carbazol-9-yl]benzimidazolo[1,2-c]quinazoline;6-[3-(9-naphthalen-2-ylcarbazol-3-yl)carbazol-9-yl]benzimidazolo[1,2-c]quinazoline;6-[3-(9-phenylcarbazol-3-yl)carbazol-9-yl]benzimidazolo[1,2-c]quinazoline
CID 158881865
6-[2-(9-naphthalen-2-ylcarbazol-2-yl)carbazol-9-yl]benzimidazolo[1,2-c]quinazoline
CID 134509081
6-[2-[3-(9-phenylcarbazol-2-yl)phenyl]carbazol-9-yl]benzimidazolo[1,2-c]quinazoline
CID 134509097
6-[2-(4-tert-butylphenyl)carbazol-9-yl]benzimidazolo[1,2-c]quinazoline
CID 134509139
6-(2-naphthalen-1-ylcarbazol-9-yl)benzimidazolo[1,2-c]quinazoline
CID 134509148
9-(benzimidazolo[1,2-c]quinazolin-6-yl)-2-N,2-N,7-N,7-N-tetraphenylcarbazole-2,7-diamine
CID 134509037

Frequently Asked Questions

What is the IUPAC name of 6-[3-(9H-acridin-10-yl)carbazol-9-yl]benzimidazolo[1,2-c]quinazoline?
The IUPAC name of 6-[3-(9H-acridin-10-yl)carbazol-9-yl]benzimidazolo[1,2-c]quinazoline (CID 145199154) is 6-[3-(9H-acridin-10-yl)carbazol-9-yl]benzimidazolo[1,2-c]quinazoline.
What is the SMILES notation for 6-[3-(9H-acridin-10-yl)carbazol-9-yl]benzimidazolo[1,2-c]quinazoline?
The canonical SMILES for 6-[3-(9H-acridin-10-yl)carbazol-9-yl]benzimidazolo[1,2-c]quinazoline is c1ccc2c(c1)Cc1ccccc1N2c1ccc2c(c1)c1ccccc1n2-c1nc2ccccc2c2nc3ccccc3n12.
What is the InChIKey of 6-[3-(9H-acridin-10-yl)carbazol-9-yl]benzimidazolo[1,2-c]quinazoline?
The InChIKey is DLHUVQNVKDDJNC-UHFFFAOYSA-N. The full InChI is InChI=1S/C39H25N5/c1-7-17-33-25(11-1)23-26-12-2-8-18-34(26)42(33)27-21-22-36-30(24-27)28-13-4-9-19-35(28)43(36)39-41-31-15-5-3-14-29(31)38-40-32-16-6-10-20-37(32)44(38)39/h1-22,24H,23H2.
What are the key properties of 6-[3-(9H-acridin-10-yl)carbazol-9-yl]benzimidazolo[1,2-c]quinazoline?
6-[3-(9H-acridin-10-yl)carbazol-9-yl]benzimidazolo[1,2-c]quinazoline has a molecular weight of 563.66 g/mol, XLogP of 9.51, 2 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[3-(9H-acridin-10-yl)carbazol-9-yl]benzimidazolo[1,2-c]quinazoline is sourced from PubChem (CID 145199154), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).