11-(7,8-didehydronaphthalen-1-yl)-5-naphthalen-1-ylindolo[3,2-b]carbazole

C38H22N2 — CID 152929477

IUPAC11-(7,8-didehydronaphthalen-1-yl)-5-naphthalen-1-ylindolo[3,2-b]carbazole
SMILESc1ccc2cccc(-n3c4ccccc4c4cc5c(cc43)c3ccccc3n5-c3cccc4ccccc34)c2c#1
InChIInChI=1S/C38H22N2/c1-3-15-27-25(11-1)13-9-21-33(27)39-35-19-7-5-17-29(35)31-24-38-32(23-37(31)39)30-18-6-8-20-36(30)40(38)34-22-10-14-26-12-2-4-16-28(26)34/h1-3,5-15,17-24H
InChIKeyUKRFMTPJFQWBTE-UHFFFAOYSA-N
MW506.61 g/mol
LogP9.79
Rot. Bonds2

About 11-(7,8-didehydronaphthalen-1-yl)-5-naphthalen-1-ylindolo[3,2-b]carbazole

11-(7,8-didehydronaphthalen-1-yl)-5-naphthalen-1-ylindolo[3,2-b]carbazole (PubChem CID 152929477) has the molecular formula C38H22N2 and a molecular weight of 506.61 g/mol. Its IUPAC name is 11-(7,8-didehydronaphthalen-1-yl)-5-naphthalen-1-ylindolo[3,2-b]carbazole.

Molecular Properties

Compound Name11-(7,8-didehydronaphthalen-1-yl)-5-naphthalen-1-ylindolo[3,2-b]carbazole
PubChem CID152929477
Molecular FormulaC38H22N2
Molecular Weight506.61 g/mol
Exact Mass506.18
IUPAC Name11-(7,8-didehydronaphthalen-1-yl)-5-naphthalen-1-ylindolo[3,2-b]carbazole
SMILESc1ccc2cccc(-n3c4ccccc4c4cc5c(cc43)c3ccccc3n5-c3cccc4ccccc34)c2c#1
InChIInChI=1S/C38H22N2/c1-3-15-27-25(11-1)13-9-21-33(27)39-35-19-7-5-17-29(35)31-24-38-32(23-37(31)39)30-18-6-8-20-36(30)40(38)34-22-10-14-26-12-2-4-16-28(26)34/h1-3,5-15,17-24H
InChIKeyUKRFMTPJFQWBTE-UHFFFAOYSA-N
XLogP9.79
TPSA9.86 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms40
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500506.61
LogP ≤ 59.79
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

9,19-dinaphthalen-1-yl-9,19-diazaoctacyclo[15.15.0.02,10.03,8.011,16.018,26.020,25.027,32]dotriaconta-1(17),2(10),3,5,7,11(16),12,18(26),20,22,24,27,29,31-tetradecaen-14-yne
CID 166702785
5,11-dinaphthalen-1-ylindolo[3,2-b]carbazol-3-amine
CID 59742334
11-(4,6-diphenyl-1,3,5-triazin-2-yl)-5-naphthalen-1-ylindolo[3,2-b]carbazole
CID 138623405
10,21-dinaphthalen-1-yl-10,21-diazapentacyclo[11.8.0.03,11.04,9.014,20]henicosa-1(13),2,4,6,8,11,14(20),15,18-nonaene
CID 154947539
2-(9-naphthalen-1-ylcarbazol-3-yl)-9-(4-phenylphenyl)carbazole
CID 142356851
5-naphthalen-1-yl-11-[4-(4-phenylphenyl)quinazolin-2-yl]indolo[3,2-b]carbazole
CID 138623408
9-naphthalen-1-yl-3-(3-phenanthren-3-ylphenyl)carbazole
CID 87171339
11-naphthalen-1-yl-5-(8-phenylnaphthalen-2-yl)indolo[3,2-b]carbazole
CID 167157220
7-naphthalen-1-yl-5-quinazolin-2-ylindolo[2,3-b]carbazole
CID 138623613
9-naphthalen-1-yl-2-[4-phenyl-6-[4-(4-phenylphenyl)phenyl]-1,3,5-triazin-2-yl]carbazole
CID 155087212
3-(4-carbazol-9-ylcarbazol-9-yl)-9-naphthalen-1-ylcarbazole
CID 134240253
9-naphthalen-1-yl-N-triphenylen-2-ylcarbazol-3-amine
CID 142740278

Frequently Asked Questions

What is the IUPAC name of 11-(7,8-didehydronaphthalen-1-yl)-5-naphthalen-1-ylindolo[3,2-b]carbazole?
The IUPAC name of 11-(7,8-didehydronaphthalen-1-yl)-5-naphthalen-1-ylindolo[3,2-b]carbazole (CID 152929477) is 11-(7,8-didehydronaphthalen-1-yl)-5-naphthalen-1-ylindolo[3,2-b]carbazole.
What is the SMILES notation for 11-(7,8-didehydronaphthalen-1-yl)-5-naphthalen-1-ylindolo[3,2-b]carbazole?
The canonical SMILES for 11-(7,8-didehydronaphthalen-1-yl)-5-naphthalen-1-ylindolo[3,2-b]carbazole is c1ccc2cccc(-n3c4ccccc4c4cc5c(cc43)c3ccccc3n5-c3cccc4ccccc34)c2c#1.
What is the InChIKey of 11-(7,8-didehydronaphthalen-1-yl)-5-naphthalen-1-ylindolo[3,2-b]carbazole?
The InChIKey is UKRFMTPJFQWBTE-UHFFFAOYSA-N. The full InChI is InChI=1S/C38H22N2/c1-3-15-27-25(11-1)13-9-21-33(27)39-35-19-7-5-17-29(35)31-24-38-32(23-37(31)39)30-18-6-8-20-36(30)40(38)34-22-10-14-26-12-2-4-16-28(26)34/h1-3,5-15,17-24H.
What are the key properties of 11-(7,8-didehydronaphthalen-1-yl)-5-naphthalen-1-ylindolo[3,2-b]carbazole?
11-(7,8-didehydronaphthalen-1-yl)-5-naphthalen-1-ylindolo[3,2-b]carbazole has a molecular weight of 506.61 g/mol, XLogP of 9.79, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 11-(7,8-didehydronaphthalen-1-yl)-5-naphthalen-1-ylindolo[3,2-b]carbazole is sourced from PubChem (CID 152929477), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).