11-benzo[k]fluoranthen-7-ylindolo[3,2-c]quinoline

C35H20N2 — CID 163478537

IUPAC11-benzo[k]fluoranthen-7-ylindolo[3,2-c]quinoline
SMILESc1ccc2c(-n3c4ccccc4c4cnc5ccccc5c43)c3c(cc2c1)-c1cccc2cccc-3c12
InChIInChI=1S/C35H20N2/c1-2-12-23-22(9-1)19-28-25-15-7-10-21-11-8-16-27(32(21)25)33(28)35(23)37-31-18-6-4-13-24(31)29-20-36-30-17-5-3-14-26(30)34(29)37/h1-20H
InChIKeyCCOPHQLVCQESPC-UHFFFAOYSA-N
MW468.56 g/mol
LogP9.29
Rot. Bonds1

About 11-benzo[k]fluoranthen-7-ylindolo[3,2-c]quinoline

11-benzo[k]fluoranthen-7-ylindolo[3,2-c]quinoline (PubChem CID 163478537) has the molecular formula C35H20N2 and a molecular weight of 468.56 g/mol. Its IUPAC name is 11-benzo[k]fluoranthen-7-ylindolo[3,2-c]quinoline.

Molecular Properties

Compound Name11-benzo[k]fluoranthen-7-ylindolo[3,2-c]quinoline
PubChem CID163478537
Molecular FormulaC35H20N2
Molecular Weight468.56 g/mol
Exact Mass468.16
IUPAC Name11-benzo[k]fluoranthen-7-ylindolo[3,2-c]quinoline
SMILESc1ccc2c(-n3c4ccccc4c4cnc5ccccc5c43)c3c(cc2c1)-c1cccc2cccc-3c12
InChIInChI=1S/C35H20N2/c1-2-12-23-22(9-1)19-28-25-15-7-10-21-11-8-16-27(32(21)25)33(28)35(23)37-31-18-6-4-13-24(31)29-20-36-30-17-5-3-14-26(30)34(29)37/h1-20H
InChIKeyCCOPHQLVCQESPC-UHFFFAOYSA-N
XLogP9.29
TPSA17.82 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms37
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500468.56
LogP ≤ 59.29
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 11-benzo[k]fluoranthen-7-ylindolo[3,2-c]quinoline?
The IUPAC name of 11-benzo[k]fluoranthen-7-ylindolo[3,2-c]quinoline (CID 163478537) is 11-benzo[k]fluoranthen-7-ylindolo[3,2-c]quinoline.
What is the SMILES notation for 11-benzo[k]fluoranthen-7-ylindolo[3,2-c]quinoline?
The canonical SMILES for 11-benzo[k]fluoranthen-7-ylindolo[3,2-c]quinoline is c1ccc2c(-n3c4ccccc4c4cnc5ccccc5c43)c3c(cc2c1)-c1cccc2cccc-3c12.
What is the InChIKey of 11-benzo[k]fluoranthen-7-ylindolo[3,2-c]quinoline?
The InChIKey is CCOPHQLVCQESPC-UHFFFAOYSA-N. The full InChI is InChI=1S/C35H20N2/c1-2-12-23-22(9-1)19-28-25-15-7-10-21-11-8-16-27(32(21)25)33(28)35(23)37-31-18-6-4-13-24(31)29-20-36-30-17-5-3-14-26(30)34(29)37/h1-20H.
What are the key properties of 11-benzo[k]fluoranthen-7-ylindolo[3,2-c]quinoline?
11-benzo[k]fluoranthen-7-ylindolo[3,2-c]quinoline has a molecular weight of 468.56 g/mol, XLogP of 9.29, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 11-benzo[k]fluoranthen-7-ylindolo[3,2-c]quinoline is sourced from PubChem (CID 163478537), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).