9-[4-[4-[2,3-bis(ethenyl)indol-1-yl]phenyl]phenyl]-2,3-dihydrocarbazole

C36H28N2 — CID 144858517

IUPAC9-[4-[4-[2,3-bis(ethenyl)indol-1-yl]phenyl]phenyl]-2,3-dihydrocarbazole
SMILESC=Cc1c(C=C)n(-c2ccc(-c3ccc(-n4c5c(c6ccccc64)=CCCC=5)cc3)cc2)c2ccccc12
InChIInChI=1S/C36H28N2/c1-3-29-30-11-5-8-14-34(30)37(33(29)4-2)27-21-17-25(18-22-27)26-19-23-28(24-20-26)38-35-15-9-6-12-31(35)32-13-7-10-16-36(32)38/h3-6,8-9,11-24H,1-2,7,10H2
InChIKeyGRYBDHIEEVLNKE-UHFFFAOYSA-N
MW488.63 g/mol
LogP7.88
Rot. Bonds5

About 9-[4-[4-[2,3-bis(ethenyl)indol-1-yl]phenyl]phenyl]-2,3-dihydrocarbazole

9-[4-[4-[2,3-bis(ethenyl)indol-1-yl]phenyl]phenyl]-2,3-dihydrocarbazole (PubChem CID 144858517) has the molecular formula C36H28N2 and a molecular weight of 488.63 g/mol. Its IUPAC name is 9-[4-[4-[2,3-bis(ethenyl)indol-1-yl]phenyl]phenyl]-2,3-dihydrocarbazole.

Molecular Properties

Compound Name9-[4-[4-[2,3-bis(ethenyl)indol-1-yl]phenyl]phenyl]-2,3-dihydrocarbazole
PubChem CID144858517
Molecular FormulaC36H28N2
Molecular Weight488.63 g/mol
Exact Mass488.23
IUPAC Name9-[4-[4-[2,3-bis(ethenyl)indol-1-yl]phenyl]phenyl]-2,3-dihydrocarbazole
SMILESC=Cc1c(C=C)n(-c2ccc(-c3ccc(-n4c5c(c6ccccc64)=CCCC=5)cc3)cc2)c2ccccc12
InChIInChI=1S/C36H28N2/c1-3-29-30-11-5-8-14-34(30)37(33(29)4-2)27-21-17-25(18-22-27)26-19-23-28(24-20-26)38-35-15-9-6-12-31(35)32-13-7-10-16-36(32)38/h3-6,8-9,11-24H,1-2,7,10H2
InChIKeyGRYBDHIEEVLNKE-UHFFFAOYSA-N
XLogP7.88
TPSA9.86 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms38
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500488.63
LogP ≤ 57.88
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2,3-bis(ethenyl)-1-(4-methylphenyl)indole
CID 91187792
9-[4-[3-(4-carbazol-9-ylphenyl)-5-[4-[3-ethenyl-2-[(Z)-prop-1-enyl]indol-1-yl]phenyl]phenyl]phenyl]carbazole
CID 174303299
4-N-[4-[4-[2-ethenyl-3-[(Z)-prop-1-enyl]indol-1-yl]phenyl]phenyl]-1-N,1-N,4-N-triphenylbenzene-1,4-diamine
CID 137384769
9-[4-[4-[2-ethenyl-3-[(Z)-prop-1-enyl]indol-1-yl]phenyl]phenyl]-3,4-dihydrocarbazole
CID 89302416
2,3-bis(ethenyl)-1-[4-[2-[4-(3-ethenyl-2-methylindol-1-yl)phenyl]propan-2-yl]phenyl]indole
CID 143119204
9-[2-[2-[(Z)-but-1-enyl]-3-ethenylindol-1-yl]phenyl]-6-methyl-2,3-dihydrocarbazole
CID 89208742
9-[3-[3-[3,5-bis(3-carbazol-9-ylphenyl)phenyl]-5-[3-(2,3-dihydrocarbazol-9-yl)phenyl]phenyl]phenyl]carbazole
CID 163995412
3-[4-[2-ethenyl-3-[(Z)-prop-1-enyl]indol-1-yl]phenyl]benzonitrile
CID 144604962
3-[4-[2,3-bis(ethenyl)indol-1-yl]phenyl]-4-phenyl-3-azapentacyclo[9.6.2.02,6.07,19.014,18]nonadeca-1(17),2(6),4,7,9,11(19),12,14(18),15-nonaene
CID 143388932
4-[6-[9-[4-(dimethylamino)phenyl]-6-[9-[4-(dimethylamino)phenyl]carbazol-3-yl]carbazol-3-yl]-2,3-dihydrocarbazol-9-yl]-N,N-dimethylaniline
CID 142088052
9-phenyl-3-[4-(9-phenyl-6,7-dihydrocarbazol-3-yl)naphthalen-1-yl]carbazole
CID 146359318
ethane;2-ethenyl-1-phenyl-3-[(Z)-prop-1-enyl]indole
CID 176690298

Frequently Asked Questions

What is the IUPAC name of 9-[4-[4-[2,3-bis(ethenyl)indol-1-yl]phenyl]phenyl]-2,3-dihydrocarbazole?
The IUPAC name of 9-[4-[4-[2,3-bis(ethenyl)indol-1-yl]phenyl]phenyl]-2,3-dihydrocarbazole (CID 144858517) is 9-[4-[4-[2,3-bis(ethenyl)indol-1-yl]phenyl]phenyl]-2,3-dihydrocarbazole.
What is the SMILES notation for 9-[4-[4-[2,3-bis(ethenyl)indol-1-yl]phenyl]phenyl]-2,3-dihydrocarbazole?
The canonical SMILES for 9-[4-[4-[2,3-bis(ethenyl)indol-1-yl]phenyl]phenyl]-2,3-dihydrocarbazole is C=Cc1c(C=C)n(-c2ccc(-c3ccc(-n4c5c(c6ccccc64)=CCCC=5)cc3)cc2)c2ccccc12.
What is the InChIKey of 9-[4-[4-[2,3-bis(ethenyl)indol-1-yl]phenyl]phenyl]-2,3-dihydrocarbazole?
The InChIKey is GRYBDHIEEVLNKE-UHFFFAOYSA-N. The full InChI is InChI=1S/C36H28N2/c1-3-29-30-11-5-8-14-34(30)37(33(29)4-2)27-21-17-25(18-22-27)26-19-23-28(24-20-26)38-35-15-9-6-12-31(35)32-13-7-10-16-36(32)38/h3-6,8-9,11-24H,1-2,7,10H2.
What are the key properties of 9-[4-[4-[2,3-bis(ethenyl)indol-1-yl]phenyl]phenyl]-2,3-dihydrocarbazole?
9-[4-[4-[2,3-bis(ethenyl)indol-1-yl]phenyl]phenyl]-2,3-dihydrocarbazole has a molecular weight of 488.63 g/mol, XLogP of 7.88, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 9-[4-[4-[2,3-bis(ethenyl)indol-1-yl]phenyl]phenyl]-2,3-dihydrocarbazole is sourced from PubChem (CID 144858517), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).