2-tert-butyl-9-[3-[5-(2-tert-butylcarbazol-9-yl)-2-methylphenyl]-4-(trifluoromethyl)phenyl]carbazole;9-[3-[5-(3,6-dimethoxycarbazol-9-yl)-2-methylphenyl]-4-(trifluoromethyl)phenyl]-3,6-dimethoxycarbazole;3-methoxy-9-[3-[5-(3-methoxycarbazol-9-yl)-2-methylphenyl]-4-(trifluoromethyl)phenyl]carbazole

C128H103F9N6O6 — CID 158206014

IUPAC2-tert-butyl-9-[3-[5-(2-tert-butylcarbazol-9-yl)-2-methylphenyl]-4-(trifluoromethyl)phenyl]carbazole;9-[3-[5-(3,6-dimethoxycarbazol-9-yl)-2-methylphenyl]-4-(trifluoromethyl)phenyl]-3,6-dimethoxycarbazole;3-methoxy-9-[3-[5-(3-methoxycarbazol-9-yl)-2-methylphenyl]-4-(trifluoromethyl)phenyl]carbazole
SMILESCOc1ccc2c(c1)c1cc(OC)ccc1n2-c1ccc(C)c(-c2cc(-n3c4ccc(OC)cc4c4cc(OC)ccc43)ccc2C(F)(F)F)c1.COc1ccc2c(c1)c1ccccc1n2-c1ccc(C)c(-c2cc(-n3c4ccccc4c4cc(OC)ccc43)ccc2C(F)(F)F)c1.Cc1ccc(-n2c3ccccc3c3ccc(C(C)(C)C)cc32)cc1-c1cc(-n2c3ccccc3c3ccc(C(C)(C)C)cc32)ccc1C(F)(F)F
InChIInChI=1S/C46H41F3N2.C42H33F3N2O4.C40H29F3N2O2/c1-28-16-19-31(50-40-14-10-8-12-33(40)35-21-17-29(24-42(35)50)44(2,3)4)26-37(28)38-27-32(20-23-39(38)46(47,48)49)51-41-15-11-9-13-34(41)36-22-18-30(25-43(36)51)45(5,6)7;1-24-6-7-25(46-38-14-9-27(48-2)20-33(38)34-21-28(49-3)10-15-39(34)46)18-31(24)32-19-26(8-13-37(32)42(43,44)45)47-40-16-11-29(50-4)22-35(40)36-23-30(51-5)12-17-41(36)47;1-24-12-13-25(44-36-10-6-4-8-29(36)33-22-27(46-2)15-18-38(33)44)20-31(24)32-21-26(14-17-35(32)40(41,42)43)45-37-11-7-5-9-30(37)34-23-28(47-3)16-19-39(34)45/h8-27H,1-7H3;6-23H,1-5H3;4-23H,1-3H3
InChIKeyGBMSZJZFAHAPLF-UHFFFAOYSA-N
MW1992.25 g/mol
LogP35.27
Rot. Bonds15

About 2-tert-butyl-9-[3-[5-(2-tert-butylcarbazol-9-yl)-2-methylphenyl]-4-(trifluoromethyl)phenyl]carbazole;9-[3-[5-(3,6-dimethoxycarbazol-9-yl)-2-methylphenyl]-4-(trifluoromethyl)phenyl]-3,6-dimethoxycarbazole;3-methoxy-9-[3-[5-(3-methoxycarbazol-9-yl)-2-methylphenyl]-4-(trifluoromethyl)phenyl]carbazole

2-tert-butyl-9-[3-[5-(2-tert-butylcarbazol-9-yl)-2-methylphenyl]-4-(trifluoromethyl)phenyl]carbazole;9-[3-[5-(3,6-dimethoxycarbazol-9-yl)-2-methylphenyl]-4-(trifluoromethyl)phenyl]-3,6-dimethoxycarbazole;3-methoxy-9-[3-[5-(3-methoxycarbazol-9-yl)-2-methylphenyl]-4-(trifluoromethyl)phenyl]carbazole (PubChem CID 158206014) has the molecular formula C128H103F9N6O6 and a molecular weight of 1992.25 g/mol. Its IUPAC name is 2-tert-butyl-9-[3-[5-(2-tert-butylcarbazol-9-yl)-2-methylphenyl]-4-(trifluoromethyl)phenyl]carbazole;9-[3-[5-(3,6-dimethoxycarbazol-9-yl)-2-methylphenyl]-4-(trifluoromethyl)phenyl]-3,6-dimethoxycarbazole;3-methoxy-9-[3-[5-(3-methoxycarbazol-9-yl)-2-methylphenyl]-4-(trifluoromethyl)phenyl]carbazole.

Molecular Properties

Compound Name2-tert-butyl-9-[3-[5-(2-tert-butylcarbazol-9-yl)-2-methylphenyl]-4-(trifluoromethyl)phenyl]carbazole;9-[3-[5-(3,6-dimethoxycarbazol-9-yl)-2-methylphenyl]-4-(trifluoromethyl)phenyl]-3,6-dimethoxycarbazole;3-methoxy-9-[3-[5-(3-methoxycarbazol-9-yl)-2-methylphenyl]-4-(trifluoromethyl)phenyl]carbazole
PubChem CID158206014
Molecular FormulaC128H103F9N6O6
Molecular Weight1992.25 g/mol
Exact Mass1990.78
IUPAC Name2-tert-butyl-9-[3-[5-(2-tert-butylcarbazol-9-yl)-2-methylphenyl]-4-(trifluoromethyl)phenyl]carbazole;9-[3-[5-(3,6-dimethoxycarbazol-9-yl)-2-methylphenyl]-4-(trifluoromethyl)phenyl]-3,6-dimethoxycarbazole;3-methoxy-9-[3-[5-(3-methoxycarbazol-9-yl)-2-methylphenyl]-4-(trifluoromethyl)phenyl]carbazole
SMILESCOc1ccc2c(c1)c1cc(OC)ccc1n2-c1ccc(C)c(-c2cc(-n3c4ccc(OC)cc4c4cc(OC)ccc43)ccc2C(F)(F)F)c1.COc1ccc2c(c1)c1ccccc1n2-c1ccc(C)c(-c2cc(-n3c4ccccc4c4cc(OC)ccc43)ccc2C(F)(F)F)c1.Cc1ccc(-n2c3ccccc3c3ccc(C(C)(C)C)cc32)cc1-c1cc(-n2c3ccccc3c3ccc(C(C)(C)C)cc32)ccc1C(F)(F)F
InChIInChI=1S/C46H41F3N2.C42H33F3N2O4.C40H29F3N2O2/c1-28-16-19-31(50-40-14-10-8-12-33(40)35-21-17-29(24-42(35)50)44(2,3)4)26-37(28)38-27-32(20-23-39(38)46(47,48)49)51-41-15-11-9-13-34(41)36-22-18-30(25-43(36)51)45(5,6)7;1-24-6-7-25(46-38-14-9-27(48-2)20-33(38)34-21-28(49-3)10-15-39(34)46)18-31(24)32-19-26(8-13-37(32)42(43,44)45)47-40-16-11-29(50-4)22-35(40)36-23-30(51-5)12-17-41(36)47;1-24-12-13-25(44-36-10-6-4-8-29(36)33-22-27(46-2)15-18-38(33)44)20-31(24)32-21-26(14-17-35(32)40(41,42)43)45-37-11-7-5-9-30(37)34-23-28(47-3)16-19-39(34)45/h8-27H,1-7H3;6-23H,1-5H3;4-23H,1-3H3
InChIKeyGBMSZJZFAHAPLF-UHFFFAOYSA-N
XLogP35.27
TPSA84.96 Ų
H-Bond Donors
H-Bond Acceptors12
Rotatable Bonds15
Heavy Atoms149
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001992.25
LogP ≤ 535.27
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1012

Analyze 2-tert-butyl-9-[3-[5-(2-tert-butylcarbazol-9-yl)-2-methylphenyl]-4-(trifluoromethyl)phenyl]carbazole;9-[3-[5-(3,6-dimethoxycarbazol-9-yl)-2-methylphenyl]-4-(trifluoromethyl)phenyl]-3,6-dimethoxycarbazole;3-methoxy-9-[3-[5-(3-methoxycarbazol-9-yl)-2-methylphenyl]-4-(trifluoromethyl)phenyl]carbazole with MolForge

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Related Compounds

9-[3-[4-(3-Carbazol-9-yl-2-fluorophenyl)-2,5-dimethoxyphenyl]-2-fluorophenyl]carbazole
CID 59147030
4-[5-fluoro-3,8-diphenoxy-11,12-bis(4-phenylphenyl)indolo[2,3-a]carbazol-6-yl]-N,N-diphenylaniline
CID 90126268
N-[4-[6-[6-[4-[N-(9,9-dimethylfluoren-2-yl)-4-[4-(1,2,2-trifluoroethenoxy)phenyl]anilino]phenyl]-9-phenylcarbazol-3-yl]-9-phenylcarbazol-3-yl]phenyl]-9,9-dimethyl-N-[4-[4-(1,2,2-trifluoroethenoxy)phenyl]phenyl]fluoren-2-amine
CID 90164118
14,14-Dimethyl-10-[4-phenyl-2,6-bis(trifluoromethyl)phenyl]-21-oxa-10-azapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(13),2,4,6,8,11,15,17,19-nonaene
CID 118927713
9-[4-[4,6-Bis(trifluoromethyl)cyclohexa-1,3-dien-1-yl]phenyl]-3,6-dimethoxycarbazole
CID 122431294
9-[2-[3,5-Bis(trifluoromethyl)phenyl]-4-(trifluoromethyl)phenyl]-3,6-dimethoxycarbazole
CID 122431325
3,6-Dimethoxy-9-[4-(trifluoromethyl)-2-[4-(trifluoromethyl)phenyl]phenyl]carbazole
CID 122431327
9-[[3,5-bis[[3,6-bis[4-(trifluoromethoxy)-N-[4-(trifluoromethoxy)phenyl]anilino]carbazol-9-yl]methyl]-2,4,6-trimethylphenyl]methyl]-3-N,3-N,6-N,6-N-tetrakis[4-(trifluoromethoxy)phenyl]carbazole-3,6-diamine
CID 122546733
9-[[4-[[3,6-bis[4-(trifluoromethoxy)-N-[4-(trifluoromethoxy)phenyl]anilino]carbazol-9-yl]methyl]phenyl]methyl]-3-N,3-N,6-N,6-N-tetrakis[4-(trifluoromethoxy)phenyl]carbazole-3,6-diamine
CID 122546742
9-[2-[4-[2-(3,6-Dimethoxycarbazol-9-yl)-5-(trifluoromethyl)phenyl]phenyl]-4-(trifluoromethyl)phenyl]-3,6-dimethoxycarbazole
CID 124173938
9-[2-[2-(3,6-Dimethoxycarbazol-9-yl)-5-(trifluoromethyl)phenyl]-4-(trifluoromethyl)phenyl]-3,6-dimethoxycarbazole
CID 124174030
9-[2-[4-[2-(3,6-Dimethoxycarbazol-9-yl)-5-(trifluoromethyl)phenyl]-2,5-dimethylphenyl]-4-(trifluoromethyl)phenyl]-3,6-dimethoxycarbazole
CID 124174127

Frequently Asked Questions

What is the IUPAC name of 2-tert-butyl-9-[3-[5-(2-tert-butylcarbazol-9-yl)-2-methylphenyl]-4-(trifluoromethyl)phenyl]carbazole;9-[3-[5-(3,6-dimethoxycarbazol-9-yl)-2-methylphenyl]-4-(trifluoromethyl)phenyl]-3,6-dimethoxycarbazole;3-methoxy-9-[3-[5-(3-methoxycarbazol-9-yl)-2-methylphenyl]-4-(trifluoromethyl)phenyl]carbazole?
The IUPAC name of 2-tert-butyl-9-[3-[5-(2-tert-butylcarbazol-9-yl)-2-methylphenyl]-4-(trifluoromethyl)phenyl]carbazole;9-[3-[5-(3,6-dimethoxycarbazol-9-yl)-2-methylphenyl]-4-(trifluoromethyl)phenyl]-3,6-dimethoxycarbazole;3-methoxy-9-[3-[5-(3-methoxycarbazol-9-yl)-2-methylphenyl]-4-(trifluoromethyl)phenyl]carbazole (CID 158206014) is 2-tert-butyl-9-[3-[5-(2-tert-butylcarbazol-9-yl)-2-methylphenyl]-4-(trifluoromethyl)phenyl]carbazole;9-[3-[5-(3,6-dimethoxycarbazol-9-yl)-2-methylphenyl]-4-(trifluoromethyl)phenyl]-3,6-dimethoxycarbazole;3-methoxy-9-[3-[5-(3-methoxycarbazol-9-yl)-2-methylphenyl]-4-(trifluoromethyl)phenyl]carbazole.
What is the SMILES notation for 2-tert-butyl-9-[3-[5-(2-tert-butylcarbazol-9-yl)-2-methylphenyl]-4-(trifluoromethyl)phenyl]carbazole;9-[3-[5-(3,6-dimethoxycarbazol-9-yl)-2-methylphenyl]-4-(trifluoromethyl)phenyl]-3,6-dimethoxycarbazole;3-methoxy-9-[3-[5-(3-methoxycarbazol-9-yl)-2-methylphenyl]-4-(trifluoromethyl)phenyl]carbazole?
The canonical SMILES for 2-tert-butyl-9-[3-[5-(2-tert-butylcarbazol-9-yl)-2-methylphenyl]-4-(trifluoromethyl)phenyl]carbazole;9-[3-[5-(3,6-dimethoxycarbazol-9-yl)-2-methylphenyl]-4-(trifluoromethyl)phenyl]-3,6-dimethoxycarbazole;3-methoxy-9-[3-[5-(3-methoxycarbazol-9-yl)-2-methylphenyl]-4-(trifluoromethyl)phenyl]carbazole is COc1ccc2c(c1)c1cc(OC)ccc1n2-c1ccc(C)c(-c2cc(-n3c4ccc(OC)cc4c4cc(OC)ccc43)ccc2C(F)(F)F)c1.COc1ccc2c(c1)c1ccccc1n2-c1ccc(C)c(-c2cc(-n3c4ccccc4c4cc(OC)ccc43)ccc2C(F)(F)F)c1.Cc1ccc(-n2c3ccccc3c3ccc(C(C)(C)C)cc32)cc1-c1cc(-n2c3ccccc3c3ccc(C(C)(C)C)cc32)ccc1C(F)(F)F.
What is the InChIKey of 2-tert-butyl-9-[3-[5-(2-tert-butylcarbazol-9-yl)-2-methylphenyl]-4-(trifluoromethyl)phenyl]carbazole;9-[3-[5-(3,6-dimethoxycarbazol-9-yl)-2-methylphenyl]-4-(trifluoromethyl)phenyl]-3,6-dimethoxycarbazole;3-methoxy-9-[3-[5-(3-methoxycarbazol-9-yl)-2-methylphenyl]-4-(trifluoromethyl)phenyl]carbazole?
The InChIKey is GBMSZJZFAHAPLF-UHFFFAOYSA-N. The full InChI is InChI=1S/C46H41F3N2.C42H33F3N2O4.C40H29F3N2O2/c1-28-16-19-31(50-40-14-10-8-12-33(40)35-21-17-29(24-42(35)50)44(2,3)4)26-37(28)38-27-32(20-23-39(38)46(47,48)49)51-41-15-11-9-13-34(41)36-22-18-30(25-43(36)51)45(5,6)7;1-24-6-7-25(46-38-14-9-27(48-2)20-33(38)34-21-28(49-3)10-15-39(34)46)18-31(24)32-19-26(8-13-37(32)42(43,44)45)47-40-16-11-29(50-4)22-35(40)36-23-30(51-5)12-17-41(36)47;1-24-12-13-25(44-36-10-6-4-8-29(36)33-22-27(46-2)15-18-38(33)44)20-31(24)32-21-26(14-17-35(32)40(41,42)43)45-37-11-7-5-9-30(37)34-23-28(47-3)16-19-39(34)45/h8-27H,1-7H3;6-23H,1-5H3;4-23H,1-3H3.
What are the key properties of 2-tert-butyl-9-[3-[5-(2-tert-butylcarbazol-9-yl)-2-methylphenyl]-4-(trifluoromethyl)phenyl]carbazole;9-[3-[5-(3,6-dimethoxycarbazol-9-yl)-2-methylphenyl]-4-(trifluoromethyl)phenyl]-3,6-dimethoxycarbazole;3-methoxy-9-[3-[5-(3-methoxycarbazol-9-yl)-2-methylphenyl]-4-(trifluoromethyl)phenyl]carbazole?
2-tert-butyl-9-[3-[5-(2-tert-butylcarbazol-9-yl)-2-methylphenyl]-4-(trifluoromethyl)phenyl]carbazole;9-[3-[5-(3,6-dimethoxycarbazol-9-yl)-2-methylphenyl]-4-(trifluoromethyl)phenyl]-3,6-dimethoxycarbazole;3-methoxy-9-[3-[5-(3-methoxycarbazol-9-yl)-2-methylphenyl]-4-(trifluoromethyl)phenyl]carbazole has a molecular weight of 1992.25 g/mol, XLogP of 35.27, 15 rotatable bonds, 0 hydrogen bond donors, and 12 hydrogen bond acceptors.
Where does this data come from?
All data for 2-tert-butyl-9-[3-[5-(2-tert-butylcarbazol-9-yl)-2-methylphenyl]-4-(trifluoromethyl)phenyl]carbazole;9-[3-[5-(3,6-dimethoxycarbazol-9-yl)-2-methylphenyl]-4-(trifluoromethyl)phenyl]-3,6-dimethoxycarbazole;3-methoxy-9-[3-[5-(3-methoxycarbazol-9-yl)-2-methylphenyl]-4-(trifluoromethyl)phenyl]carbazole is sourced from PubChem (CID 158206014), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).