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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Related Compounds

10-(4,6-diphenyl-1,3,5-triazin-2-yl)-10-azahexacyclo[13.7.1.02,14.03,11.04,9.019,23]tricosa-1(22),2(14),3(11),4,6,8,12,15,17,19(23),20-undecaene
CID 118564899
9-quinolin-3-ylcarbazole
CID 138984974
7,12-di(anthracen-9-yl)benzo[j]phenanthridine
CID 59183577
12-[4-[3-(9-phenylcarbazol-3-yl)carbazol-9-yl]phenyl]-11,13-diazatetracyclo[7.6.1.05,16.010,15]hexadeca-1,3,5(16),6,8,10,12,14-octaene
CID 122466417
4-[9-(4-phenylphenyl)carbazol-3-yl]-4-azahexacyclo[13.7.1.02,14.03,11.05,10.019,23]tricosa-1(22),2(14),3(11),5,7,9,12,15,17,19(23),20-undecaene
CID 118565132
13-[4-[4-(9-phenylcarbazol-3-yl)phenyl]phenyl]-12-azatetracyclo[7.6.1.05,16.010,15]hexadeca-1,3,5(16),6,8,10,12,14-octaene
CID 122434747
4-(4-phenylphenyl)-4-azahexacyclo[13.7.1.02,14.03,11.05,10.019,23]tricosa-1(22),2(14),3(11),5,7,9,12,15,17,19(23),20-undecaene
CID 118564873
11,13-bis(carbazol-9-ylmethyl)-12-azatetracyclo[7.6.1.05,16.010,15]hexadeca-1,3,5(16),6,8,10(15),11,13-octaene
CID 122466573
10-[4-(4-phenylquinazolin-2-yl)phenyl]-10-azahexacyclo[13.7.1.02,14.03,11.04,9.019,23]tricosa-1(22),2(14),3(11),4,6,8,12,15,17,19(23),20-undecaene
CID 118564966
undecacyclo[27.11.1.111,15.02,28.04,26.05,23.08,22.010,20.030,35.037,41.019,42]dotetraconta-1(40),2(28),3,5(23),6,8,10(20),11,13,15(42),16,18,21,24,26,29(41),30,32,34,36,38-henicosaene
CID 163913395
3-[4-(11-oxahexacyclo[13.7.1.02,14.04,12.05,10.019,23]tricosa-1(22),2,4(12),5,7,9,13,15,17,19(23),20-undecaen-3-yl)-6-phenyl-1,3,5-triazin-2-yl]-9-phenylcarbazole
CID 163430381
15-quinolin-4-yl-15-azaheptacyclo[12.11.0.02,11.03,8.04,23.016,25.019,24]pentacosa-1(14),2(11),3(8),4,6,9,12,16(25),17,19(24),20,22-dodecaene
CID 162770142

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).