9-(3,5-dibromophenyl)-3-[2-ethenyl-1-phenyl-3-[(Z)-prop-1-enyl]indol-5-yl]carbazole

C37H26Br2N2 — CID 145163222

IUPAC9-(3,5-dibromophenyl)-3-[2-ethenyl-1-phenyl-3-[(Z)-prop-1-enyl]indol-5-yl]carbazole
SMILESC=Cc1c(/C=C\C)c2cc(-c3ccc4c(c3)c3ccccc3n4-c3cc(Br)cc(Br)c3)ccc2n1-c1ccccc1
InChIInChI=1S/C37H26Br2N2/c1-3-10-30-32-19-24(15-17-36(32)40(34(30)4-2)28-11-6-5-7-12-28)25-16-18-37-33(20-25)31-13-8-9-14-35(31)41(37)29-22-26(38)21-27(39)23-29/h3-23H,2H2,1H3/b10-3-
InChIKeyYTRNLXOBQZEJTE-KMKOMSMNSA-N
MW658.44 g/mol
LogP11.60
Rot. Bonds5

About 9-(3,5-dibromophenyl)-3-[2-ethenyl-1-phenyl-3-[(Z)-prop-1-enyl]indol-5-yl]carbazole

9-(3,5-dibromophenyl)-3-[2-ethenyl-1-phenyl-3-[(Z)-prop-1-enyl]indol-5-yl]carbazole (PubChem CID 145163222) has the molecular formula C37H26Br2N2 and a molecular weight of 658.44 g/mol. Its IUPAC name is 9-(3,5-dibromophenyl)-3-[2-ethenyl-1-phenyl-3-[(Z)-prop-1-enyl]indol-5-yl]carbazole.

Molecular Properties

Compound Name9-(3,5-dibromophenyl)-3-[2-ethenyl-1-phenyl-3-[(Z)-prop-1-enyl]indol-5-yl]carbazole
PubChem CID145163222
Molecular FormulaC37H26Br2N2
Molecular Weight658.44 g/mol
Exact Mass656.05
IUPAC Name9-(3,5-dibromophenyl)-3-[2-ethenyl-1-phenyl-3-[(Z)-prop-1-enyl]indol-5-yl]carbazole
SMILESC=Cc1c(/C=C\C)c2cc(-c3ccc4c(c3)c3ccccc3n4-c3cc(Br)cc(Br)c3)ccc2n1-c1ccccc1
InChIInChI=1S/C37H26Br2N2/c1-3-10-30-32-19-24(15-17-36(32)40(34(30)4-2)28-11-6-5-7-12-28)25-16-18-37-33(20-25)31-13-8-9-14-35(31)41(37)29-22-26(38)21-27(39)23-29/h3-23H,2H2,1H3/b10-3-
InChIKeyYTRNLXOBQZEJTE-KMKOMSMNSA-N
XLogP11.60
TPSA9.86 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms41
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500658.44
LogP ≤ 511.60
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 9-(3,5-dibromophenyl)-3-[2-ethenyl-1-phenyl-3-[(Z)-prop-1-enyl]indol-5-yl]carbazole with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

3-[2-ethenyl-1-[4-(4-phenylphenyl)phenyl]-3-[(Z)-prop-1-enyl]indol-5-yl]-9-(2-phenylphenyl)carbazole
CID 177063540
9-[3-[3-[2-ethenyl-3-[(Z)-prop-1-enyl]indol-1-yl]phenyl]phenyl]carbazole
CID 89315996
ethane;3-[2-ethenyl-1-[4-[(3E)-hexa-1,3,5-trien-3-yl]phenyl]-3-[(Z)-prop-1-enyl]indol-5-yl]-9-phenylcarbazole
CID 177063270
N-[4-[4-(N-[2-ethenyl-1-phenyl-3-[(Z)-prop-1-enyl]indol-5-yl]-4-methylanilino)phenyl]phenyl]-N-(4-methylphenyl)-9-phenylcarbazol-3-amine
CID 130309344
ethane;2-ethenyl-1-phenyl-3-[(Z)-prop-1-enyl]indole
CID 176690298
1-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-2-ethenyl-9-phenyl-3-[(Z)-prop-1-enyl]pyrrolo[2,3-b]carbazole
CID 138534156
ethane;3-[6-[2-ethenyl-1-phenyl-3-[(Z)-prop-1-enyl]indol-5-yl]-9,10-diphenylanthracen-2-yl]-9-[(3E,5Z)-hepta-1,3,5-trien-4-yl]carbazole
CID 143933879
2-ethenyl-1,10-diphenyl-3-[(Z)-prop-1-enyl]pyrrolo[2,3-a]carbazole
CID 138736833
5-bromo-3-ethenyl-1-phenyl-2-[(Z)-prop-1-enyl]indole
CID 144919540
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
3-(3-bromo-5-phenylphenyl)-9-phenylcarbazole
CID 90030350
N-[4-[4-[3-ethenyl-1-phenyl-2-[(Z)-prop-1-enyl]indol-5-yl]phenyl]phenyl]-N,4-diphenylaniline
CID 170106811

Frequently Asked Questions

What is the IUPAC name of 9-(3,5-dibromophenyl)-3-[2-ethenyl-1-phenyl-3-[(Z)-prop-1-enyl]indol-5-yl]carbazole?
The IUPAC name of 9-(3,5-dibromophenyl)-3-[2-ethenyl-1-phenyl-3-[(Z)-prop-1-enyl]indol-5-yl]carbazole (CID 145163222) is 9-(3,5-dibromophenyl)-3-[2-ethenyl-1-phenyl-3-[(Z)-prop-1-enyl]indol-5-yl]carbazole.
What is the SMILES notation for 9-(3,5-dibromophenyl)-3-[2-ethenyl-1-phenyl-3-[(Z)-prop-1-enyl]indol-5-yl]carbazole?
The canonical SMILES for 9-(3,5-dibromophenyl)-3-[2-ethenyl-1-phenyl-3-[(Z)-prop-1-enyl]indol-5-yl]carbazole is C=Cc1c(/C=C\C)c2cc(-c3ccc4c(c3)c3ccccc3n4-c3cc(Br)cc(Br)c3)ccc2n1-c1ccccc1.
What is the InChIKey of 9-(3,5-dibromophenyl)-3-[2-ethenyl-1-phenyl-3-[(Z)-prop-1-enyl]indol-5-yl]carbazole?
The InChIKey is YTRNLXOBQZEJTE-KMKOMSMNSA-N. The full InChI is InChI=1S/C37H26Br2N2/c1-3-10-30-32-19-24(15-17-36(32)40(34(30)4-2)28-11-6-5-7-12-28)25-16-18-37-33(20-25)31-13-8-9-14-35(31)41(37)29-22-26(38)21-27(39)23-29/h3-23H,2H2,1H3/b10-3-.
What are the key properties of 9-(3,5-dibromophenyl)-3-[2-ethenyl-1-phenyl-3-[(Z)-prop-1-enyl]indol-5-yl]carbazole?
9-(3,5-dibromophenyl)-3-[2-ethenyl-1-phenyl-3-[(Z)-prop-1-enyl]indol-5-yl]carbazole has a molecular weight of 658.44 g/mol, XLogP of 11.60, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 9-(3,5-dibromophenyl)-3-[2-ethenyl-1-phenyl-3-[(Z)-prop-1-enyl]indol-5-yl]carbazole is sourced from PubChem (CID 145163222), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).