6-(4-carbazol-9-yl-6-phenyl-1,3,5-triazin-2-yl)-9,9-dimethyl-1-(2-methylphenyl)fluoren-2-ol

C43H32N4O — CID 138646022

IUPAC6-(4-carbazol-9-yl-6-phenyl-1,3,5-triazin-2-yl)-9,9-dimethyl-1-(2-methylphenyl)fluoren-2-ol
SMILESCc1ccccc1-c1c(O)ccc2c1C(C)(C)c1ccc(-c3nc(-c4ccccc4)nc(-n4c5ccccc5c5ccccc54)n3)cc1-2
InChIInChI=1S/C43H32N4O/c1-26-13-7-8-16-29(26)38-37(48)24-22-32-33-25-28(21-23-34(33)43(2,3)39(32)38)41-44-40(27-14-5-4-6-15-27)45-42(46-41)47-35-19-11-9-17-30(35)31-18-10-12-20-36(31)47/h4-25,48H,1-3H3
InChIKeyJQAZHRXANGPBJD-UHFFFAOYSA-N
MW620.76 g/mol
LogP10.29
Rot. Bonds4

About 6-(4-carbazol-9-yl-6-phenyl-1,3,5-triazin-2-yl)-9,9-dimethyl-1-(2-methylphenyl)fluoren-2-ol

6-(4-carbazol-9-yl-6-phenyl-1,3,5-triazin-2-yl)-9,9-dimethyl-1-(2-methylphenyl)fluoren-2-ol (PubChem CID 138646022) has the molecular formula C43H32N4O and a molecular weight of 620.76 g/mol. Its IUPAC name is 6-(4-carbazol-9-yl-6-phenyl-1,3,5-triazin-2-yl)-9,9-dimethyl-1-(2-methylphenyl)fluoren-2-ol.

Molecular Properties

Compound Name6-(4-carbazol-9-yl-6-phenyl-1,3,5-triazin-2-yl)-9,9-dimethyl-1-(2-methylphenyl)fluoren-2-ol
PubChem CID138646022
Molecular FormulaC43H32N4O
Molecular Weight620.76 g/mol
Exact Mass620.26
IUPAC Name6-(4-carbazol-9-yl-6-phenyl-1,3,5-triazin-2-yl)-9,9-dimethyl-1-(2-methylphenyl)fluoren-2-ol
SMILESCc1ccccc1-c1c(O)ccc2c1C(C)(C)c1ccc(-c3nc(-c4ccccc4)nc(-n4c5ccccc5c5ccccc54)n3)cc1-2
InChIInChI=1S/C43H32N4O/c1-26-13-7-8-16-29(26)38-37(48)24-22-32-33-25-28(21-23-34(33)43(2,3)39(32)38)41-44-40(27-14-5-4-6-15-27)45-42(46-41)47-35-19-11-9-17-30(35)31-18-10-12-20-36(31)47/h4-25,48H,1-3H3
InChIKeyJQAZHRXANGPBJD-UHFFFAOYSA-N
XLogP10.29
TPSA63.83 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms48
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500620.76
LogP ≤ 510.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

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2-[2-[4-(2-Carbazol-9-ylcarbazol-9-yl)-6-phenyl-1,3,5-triazin-2-yl]-6-fluorophenyl]phenol
CID 146648692
3-[2-Fluoro-3-[4-phenyl-6-(11-phenylindolo[2,3-a]carbazol-12-yl)-1,3,5-triazin-2-yl]phenyl]naphthalen-2-ol
CID 164030682
2-[2-Fluoro-6-[4-(4-phenylphenyl)-6-[11-(4-phenylphenyl)indolo[2,3-a]carbazol-12-yl]-1,3,5-triazin-2-yl]phenyl]-3-phenylphenol
CID 164758267
2-[2-Fluoro-6-[4-phenyl-6-[11-(4-phenylphenyl)indolo[2,3-a]carbazol-12-yl]-1,3,5-triazin-2-yl]phenyl]-3-phenylphenol
CID 164758313
2-[2-Fluoro-6-[4-(4-phenylphenyl)-6-[14-(4-phenylphenyl)-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaen-9-yl]-1,3,5-triazin-2-yl]phenyl]-4-phenylphenol
CID 167048565
2-[2-Fluoro-6-[4-(4-phenylphenyl)-6-[11-(3-phenylphenyl)indolo[2,3-a]carbazol-12-yl]-1,3,5-triazin-2-yl]phenyl]-3-phenylphenol
CID 167048570
2-[2-Fluoro-6-[4-(4-phenylphenyl)-6-[5-(4-phenylphenyl)indolo[3,2-c]carbazol-12-yl]-1,3,5-triazin-2-yl]phenyl]-3-phenylphenol
CID 167048571
2-[2-Fluoro-6-methyl-3-[1-[4-phenyl-2,6-di(propan-2-yl)phenyl]benzimidazol-2-yl]phenyl]phenanthren-3-ol
CID 172561548
CID 174141417
CID 174141417
3-[3-[2,6-Di(propan-2-yl)phenyl]-5-fluoro-2-phenylbenzimidazol-4-yl]phenanthren-2-ol
CID 176176633

Frequently Asked Questions

What is the IUPAC name of 6-(4-carbazol-9-yl-6-phenyl-1,3,5-triazin-2-yl)-9,9-dimethyl-1-(2-methylphenyl)fluoren-2-ol?
The IUPAC name of 6-(4-carbazol-9-yl-6-phenyl-1,3,5-triazin-2-yl)-9,9-dimethyl-1-(2-methylphenyl)fluoren-2-ol (CID 138646022) is 6-(4-carbazol-9-yl-6-phenyl-1,3,5-triazin-2-yl)-9,9-dimethyl-1-(2-methylphenyl)fluoren-2-ol.
What is the SMILES notation for 6-(4-carbazol-9-yl-6-phenyl-1,3,5-triazin-2-yl)-9,9-dimethyl-1-(2-methylphenyl)fluoren-2-ol?
The canonical SMILES for 6-(4-carbazol-9-yl-6-phenyl-1,3,5-triazin-2-yl)-9,9-dimethyl-1-(2-methylphenyl)fluoren-2-ol is Cc1ccccc1-c1c(O)ccc2c1C(C)(C)c1ccc(-c3nc(-c4ccccc4)nc(-n4c5ccccc5c5ccccc54)n3)cc1-2.
What is the InChIKey of 6-(4-carbazol-9-yl-6-phenyl-1,3,5-triazin-2-yl)-9,9-dimethyl-1-(2-methylphenyl)fluoren-2-ol?
The InChIKey is JQAZHRXANGPBJD-UHFFFAOYSA-N. The full InChI is InChI=1S/C43H32N4O/c1-26-13-7-8-16-29(26)38-37(48)24-22-32-33-25-28(21-23-34(33)43(2,3)39(32)38)41-44-40(27-14-5-4-6-15-27)45-42(46-41)47-35-19-11-9-17-30(35)31-18-10-12-20-36(31)47/h4-25,48H,1-3H3.
What are the key properties of 6-(4-carbazol-9-yl-6-phenyl-1,3,5-triazin-2-yl)-9,9-dimethyl-1-(2-methylphenyl)fluoren-2-ol?
6-(4-carbazol-9-yl-6-phenyl-1,3,5-triazin-2-yl)-9,9-dimethyl-1-(2-methylphenyl)fluoren-2-ol has a molecular weight of 620.76 g/mol, XLogP of 10.29, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(4-carbazol-9-yl-6-phenyl-1,3,5-triazin-2-yl)-9,9-dimethyl-1-(2-methylphenyl)fluoren-2-ol is sourced from PubChem (CID 138646022), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).