3-[9-[3,5-bis(3-fluorophenyl)phenyl]-3,4-dihydrocarbazol-3-yl]-9-phenylcarbazole

C48H32F2N2 — CID 163674925

IUPAC3-[9-[3,5-bis(3-fluorophenyl)phenyl]-3,4-dihydrocarbazol-3-yl]-9-phenylcarbazole
SMILESFc1cccc(-c2cc(-c3cccc(F)c3)cc(-n3c4c(c5ccccc53)CC(c3ccc5c(c3)c3ccccc3n5-c3ccccc3)C=C4)c2)c1
InChIInChI=1S/C48H32F2N2/c49-37-12-8-10-31(25-37)35-24-36(32-11-9-13-38(50)26-32)28-40(27-35)52-46-19-7-5-17-42(46)44-30-34(21-23-48(44)52)33-20-22-47-43(29-33)41-16-4-6-18-45(41)51(47)39-14-2-1-3-15-39/h1-29,34H,30H2
InChIKeyJFVDUPWFCMZUSO-UHFFFAOYSA-N
MW674.79 g/mol
LogP12.69
Rot. Bonds5

About 3-[9-[3,5-bis(3-fluorophenyl)phenyl]-3,4-dihydrocarbazol-3-yl]-9-phenylcarbazole

3-[9-[3,5-bis(3-fluorophenyl)phenyl]-3,4-dihydrocarbazol-3-yl]-9-phenylcarbazole (PubChem CID 163674925) has the molecular formula C48H32F2N2 and a molecular weight of 674.79 g/mol. Its IUPAC name is 3-[9-[3,5-bis(3-fluorophenyl)phenyl]-3,4-dihydrocarbazol-3-yl]-9-phenylcarbazole.

Molecular Properties

Compound Name3-[9-[3,5-bis(3-fluorophenyl)phenyl]-3,4-dihydrocarbazol-3-yl]-9-phenylcarbazole
PubChem CID163674925
Molecular FormulaC48H32F2N2
Molecular Weight674.79 g/mol
Exact Mass674.25
IUPAC Name3-[9-[3,5-bis(3-fluorophenyl)phenyl]-3,4-dihydrocarbazol-3-yl]-9-phenylcarbazole
SMILESFc1cccc(-c2cc(-c3cccc(F)c3)cc(-n3c4c(c5ccccc53)CC(c3ccc5c(c3)c3ccccc3n5-c3ccccc3)C=C4)c2)c1
InChIInChI=1S/C48H32F2N2/c49-37-12-8-10-31(25-37)35-24-36(32-11-9-13-38(50)26-32)28-40(27-35)52-46-19-7-5-17-42(46)44-30-34(21-23-48(44)52)33-20-22-47-43(29-33)41-16-4-6-18-45(41)51(47)39-14-2-1-3-15-39/h1-29,34H,30H2
InChIKeyJFVDUPWFCMZUSO-UHFFFAOYSA-N
XLogP12.69
TPSA9.86 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms52
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500674.79
LogP ≤ 512.69
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 3-[9-[3,5-bis(3-fluorophenyl)phenyl]-3,4-dihydrocarbazol-3-yl]-9-phenylcarbazole 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

N,N-diphenyl-4-[3-[9-(3-phenylphenyl)-3,4-dihydrocarbazol-3-yl]carbazol-9-yl]aniline
CID 166696096
9-phenyl-3-[9-[4-(3-phenylphenyl)-1,2-dihydroquinolin-2-yl]-3,4-dihydrocarbazol-3-yl]carbazole
CID 118535789
2-(4-methylphenyl)-5-[4-[3-(9-phenyl-3,4-dihydrocarbazol-3-yl)carbazol-9-yl]phenyl]-1,3,4-oxadiazole
CID 71086025
5-[9-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazol-3-yl]-9-phenyl-9-azahexacyclo[10.10.1.02,10.03,8.013,18.019,23]tricosa-1(23),2(10),3(8),6,11,13,15,17,19,21-decaene
CID 134301201
9-[3-[6-[3-(3,6-diphenyl-3,4-dihydrocarbazol-9-yl)phenyl]-1,8-diphenylphenanthren-3-yl]phenyl]-3,6-diphenylcarbazole
CID 89046059
4-[8-(9-phenyl-3,4-dihydrocarbazol-3-yl)dibenzothiophen-2-yl]benzonitrile
CID 135233863
9-phenyl-1-(9-phenyl-3,4-dihydrocarbazol-3-yl)carbazole
CID 118228720
9-benzyl-1-phenyl-6-(9-phenyl-3,4-dihydrocarbazol-3-yl)pyrido[3,4-b]indole
CID 145327325
9-[3-(4,6-diphenyl-1,3,5-triazinan-2-yl)phenyl]-3-phenyl-3,4-dihydrocarbazole
CID 145085569
3-[3-[9-(3,5-diphenylphenyl)carbazol-3-yl]phenyl]-9-phenylcarbazole;9-(3-phenylphenyl)-3-[3-[9-(4-phenylphenyl)carbazol-3-yl]phenyl]carbazole
CID 158535060
3-[9-[3-(3-phenylphenyl)phenyl]carbazol-3-yl]-9-[3-phenyl-5-(3-phenylphenyl)phenyl]carbazole
CID 157108405
3-[9-(3,5-diphenylphenyl)carbazol-3-yl]-9-phenylcarbazole;3-[9-(3,5-diphenylphenyl)carbazol-3-yl]-9-(4-phenylphenyl)carbazole
CID 161445204

Frequently Asked Questions

What is the IUPAC name of 3-[9-[3,5-bis(3-fluorophenyl)phenyl]-3,4-dihydrocarbazol-3-yl]-9-phenylcarbazole?
The IUPAC name of 3-[9-[3,5-bis(3-fluorophenyl)phenyl]-3,4-dihydrocarbazol-3-yl]-9-phenylcarbazole (CID 163674925) is 3-[9-[3,5-bis(3-fluorophenyl)phenyl]-3,4-dihydrocarbazol-3-yl]-9-phenylcarbazole.
What is the SMILES notation for 3-[9-[3,5-bis(3-fluorophenyl)phenyl]-3,4-dihydrocarbazol-3-yl]-9-phenylcarbazole?
The canonical SMILES for 3-[9-[3,5-bis(3-fluorophenyl)phenyl]-3,4-dihydrocarbazol-3-yl]-9-phenylcarbazole is Fc1cccc(-c2cc(-c3cccc(F)c3)cc(-n3c4c(c5ccccc53)CC(c3ccc5c(c3)c3ccccc3n5-c3ccccc3)C=C4)c2)c1.
What is the InChIKey of 3-[9-[3,5-bis(3-fluorophenyl)phenyl]-3,4-dihydrocarbazol-3-yl]-9-phenylcarbazole?
The InChIKey is JFVDUPWFCMZUSO-UHFFFAOYSA-N. The full InChI is InChI=1S/C48H32F2N2/c49-37-12-8-10-31(25-37)35-24-36(32-11-9-13-38(50)26-32)28-40(27-35)52-46-19-7-5-17-42(46)44-30-34(21-23-48(44)52)33-20-22-47-43(29-33)41-16-4-6-18-45(41)51(47)39-14-2-1-3-15-39/h1-29,34H,30H2.
What are the key properties of 3-[9-[3,5-bis(3-fluorophenyl)phenyl]-3,4-dihydrocarbazol-3-yl]-9-phenylcarbazole?
3-[9-[3,5-bis(3-fluorophenyl)phenyl]-3,4-dihydrocarbazol-3-yl]-9-phenylcarbazole has a molecular weight of 674.79 g/mol, XLogP of 12.69, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[9-[3,5-bis(3-fluorophenyl)phenyl]-3,4-dihydrocarbazol-3-yl]-9-phenylcarbazole is sourced from PubChem (CID 163674925), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).