1-[1,2,3,4,5,6,8-heptamethyl-9-(3,4,5,6,7-pentamethylindazol-1-yl)-7-(2,3,4,5,6-pentamethylphenyl)fluoren-9-yl]-3,4,5,6,7-pentamethylindazole

C55H66N4 — CID 59181223

IUPAC1-[1,2,3,4,5,6,8-heptamethyl-9-(3,4,5,6,7-pentamethylindazol-1-yl)-7-(2,3,4,5,6-pentamethylphenyl)fluoren-9-yl]-3,4,5,6,7-pentamethylindazole
SMILESCc1c(C)c(C)c(-c2c(C)c(C)c3c(c2C)C(n2nc(C)c4c(C)c(C)c(C)c(C)c42)(n2nc(C)c4c(C)c(C)c(C)c(C)c42)c2c(C)c(C)c(C)c(C)c2-3)c(C)c1C
InChIInChI=1S/C55H66N4/c1-23-24(2)32(10)45(33(11)25(23)3)46-37(15)38(16)50-49-36(14)26(4)29(7)39(17)51(49)55(52(50)42(46)20,58-53-40(18)30(8)27(5)34(12)47(53)43(21)56-58)59-54-41(19)31(9)28(6)35(13)48(54)44(22)57-59/h1-22H3
InChIKeyZVTOBUOMCWEEKH-UHFFFAOYSA-N
MW783.16 g/mol
LogP14.12
Rot. Bonds3

About 1-[1,2,3,4,5,6,8-heptamethyl-9-(3,4,5,6,7-pentamethylindazol-1-yl)-7-(2,3,4,5,6-pentamethylphenyl)fluoren-9-yl]-3,4,5,6,7-pentamethylindazole

1-[1,2,3,4,5,6,8-heptamethyl-9-(3,4,5,6,7-pentamethylindazol-1-yl)-7-(2,3,4,5,6-pentamethylphenyl)fluoren-9-yl]-3,4,5,6,7-pentamethylindazole (PubChem CID 59181223) has the molecular formula C55H66N4 and a molecular weight of 783.16 g/mol. Its IUPAC name is 1-[1,2,3,4,5,6,8-heptamethyl-9-(3,4,5,6,7-pentamethylindazol-1-yl)-7-(2,3,4,5,6-pentamethylphenyl)fluoren-9-yl]-3,4,5,6,7-pentamethylindazole.

Molecular Properties

Compound Name1-[1,2,3,4,5,6,8-heptamethyl-9-(3,4,5,6,7-pentamethylindazol-1-yl)-7-(2,3,4,5,6-pentamethylphenyl)fluoren-9-yl]-3,4,5,6,7-pentamethylindazole
PubChem CID59181223
Molecular FormulaC55H66N4
Molecular Weight783.16 g/mol
Exact Mass782.53
IUPAC Name1-[1,2,3,4,5,6,8-heptamethyl-9-(3,4,5,6,7-pentamethylindazol-1-yl)-7-(2,3,4,5,6-pentamethylphenyl)fluoren-9-yl]-3,4,5,6,7-pentamethylindazole
SMILESCc1c(C)c(C)c(-c2c(C)c(C)c3c(c2C)C(n2nc(C)c4c(C)c(C)c(C)c(C)c42)(n2nc(C)c4c(C)c(C)c(C)c(C)c42)c2c(C)c(C)c(C)c(C)c2-3)c(C)c1C
InChIInChI=1S/C55H66N4/c1-23-24(2)32(10)45(33(11)25(23)3)46-37(15)38(16)50-49-36(14)26(4)29(7)39(17)51(49)55(52(50)42(46)20,58-53-40(18)30(8)27(5)34(12)47(53)43(21)56-58)59-54-41(19)31(9)28(6)35(13)48(54)44(22)57-59/h1-22H3
InChIKeyZVTOBUOMCWEEKH-UHFFFAOYSA-N
XLogP14.12
TPSA35.64 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms59
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500783.16
LogP ≤ 514.12
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 1-[1,2,3,4,5,6,8-heptamethyl-9-(3,4,5,6,7-pentamethylindazol-1-yl)-7-(2,3,4,5,6-pentamethylphenyl)fluoren-9-yl]-3,4,5,6,7-pentamethylindazole 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

2-[9-(1,3,4,5,6,7-hexamethylindol-2-yl)-1,2,3,4,5,6,8-heptamethyl-7-(2,3,4,5,6-pentamethylphenyl)fluoren-9-yl]-1,3,4,5,6,7-hexamethylindole
CID 59246614
3,4,5,6,7-pentamethyl-1-[2,3,5,6-tetramethyl-4-(3,4,5,6,7-pentamethylindazol-1-yl)phenyl]indazole
CID 59181170
1,3,4,6,7-pentamethyl-5-[2,3,5,6-tetramethyl-4-[2-[2,3,5,6-tetramethyl-4-(1,3,4,6,7-pentamethylindazol-5-yl)phenyl]propan-2-yl]phenyl]indazole
CID 59181203
1-[4,6-dimethyl-2-(3,4,5,6,7-pentamethylindazol-1-yl)pyrimidin-5-yl]-3,4,5,6,7-pentamethylindazole
CID 58250526
9-ethyl-3-(9-ethyl-1,2,4,5,6,7,8-heptamethylcarbazol-3-yl)-1,2,4,5,6,7,8-heptamethylcarbazole
CID 170176865
1,2,3,4,5-pentamethyl-6-[2,3,5,6-tetramethyl-4-[2,3,5,6-tetramethyl-4-(2,3,4,5,6-pentamethylphenyl)phenyl]phenyl]benzene
CID 145429848
1,2,3,4,5-pentamethyl-6-(2,3,4,5,6-pentamethylphenyl)benzene
CID 157259887
1,2,3,4,6,7-hexamethyl-5-(2,3,4,5,6-pentamethylphenyl)indole
CID 59246608
1,2,3,5,6,7-hexamethyl-4-(2,3,4,5,6-pentamethylphenyl)indole
CID 59246621
1,2,3,4,5,7,8,9,10,12-decamethyl-6,11-bis(2,3,4,5,6-pentamethylphenyl)tetracene
CID 59816825
methane;bis(1,2,3,4,5-pentamethyl-6-(2,3,4,5,6-pentamethylphenyl)benzene)
CID 163470623
3,4,5,6,7-pentamethyl-1-[(1-methyl-1,2,4-triazol-3-yl)methyl]indazole
CID 22948906

Frequently Asked Questions

What is the IUPAC name of 1-[1,2,3,4,5,6,8-heptamethyl-9-(3,4,5,6,7-pentamethylindazol-1-yl)-7-(2,3,4,5,6-pentamethylphenyl)fluoren-9-yl]-3,4,5,6,7-pentamethylindazole?
The IUPAC name of 1-[1,2,3,4,5,6,8-heptamethyl-9-(3,4,5,6,7-pentamethylindazol-1-yl)-7-(2,3,4,5,6-pentamethylphenyl)fluoren-9-yl]-3,4,5,6,7-pentamethylindazole (CID 59181223) is 1-[1,2,3,4,5,6,8-heptamethyl-9-(3,4,5,6,7-pentamethylindazol-1-yl)-7-(2,3,4,5,6-pentamethylphenyl)fluoren-9-yl]-3,4,5,6,7-pentamethylindazole.
What is the SMILES notation for 1-[1,2,3,4,5,6,8-heptamethyl-9-(3,4,5,6,7-pentamethylindazol-1-yl)-7-(2,3,4,5,6-pentamethylphenyl)fluoren-9-yl]-3,4,5,6,7-pentamethylindazole?
The canonical SMILES for 1-[1,2,3,4,5,6,8-heptamethyl-9-(3,4,5,6,7-pentamethylindazol-1-yl)-7-(2,3,4,5,6-pentamethylphenyl)fluoren-9-yl]-3,4,5,6,7-pentamethylindazole is Cc1c(C)c(C)c(-c2c(C)c(C)c3c(c2C)C(n2nc(C)c4c(C)c(C)c(C)c(C)c42)(n2nc(C)c4c(C)c(C)c(C)c(C)c42)c2c(C)c(C)c(C)c(C)c2-3)c(C)c1C.
What is the InChIKey of 1-[1,2,3,4,5,6,8-heptamethyl-9-(3,4,5,6,7-pentamethylindazol-1-yl)-7-(2,3,4,5,6-pentamethylphenyl)fluoren-9-yl]-3,4,5,6,7-pentamethylindazole?
The InChIKey is ZVTOBUOMCWEEKH-UHFFFAOYSA-N. The full InChI is InChI=1S/C55H66N4/c1-23-24(2)32(10)45(33(11)25(23)3)46-37(15)38(16)50-49-36(14)26(4)29(7)39(17)51(49)55(52(50)42(46)20,58-53-40(18)30(8)27(5)34(12)47(53)43(21)56-58)59-54-41(19)31(9)28(6)35(13)48(54)44(22)57-59/h1-22H3.
What are the key properties of 1-[1,2,3,4,5,6,8-heptamethyl-9-(3,4,5,6,7-pentamethylindazol-1-yl)-7-(2,3,4,5,6-pentamethylphenyl)fluoren-9-yl]-3,4,5,6,7-pentamethylindazole?
1-[1,2,3,4,5,6,8-heptamethyl-9-(3,4,5,6,7-pentamethylindazol-1-yl)-7-(2,3,4,5,6-pentamethylphenyl)fluoren-9-yl]-3,4,5,6,7-pentamethylindazole has a molecular weight of 783.16 g/mol, XLogP of 14.12, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[1,2,3,4,5,6,8-heptamethyl-9-(3,4,5,6,7-pentamethylindazol-1-yl)-7-(2,3,4,5,6-pentamethylphenyl)fluoren-9-yl]-3,4,5,6,7-pentamethylindazole is sourced from PubChem (CID 59181223), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).