[5-(3-carbazol-9-ylphenyl)-2-methylphenyl]-(2-methylphenyl)methanone

C33H25NO — CID 145157854

IUPAC[5-(3-carbazol-9-ylphenyl)-2-methylphenyl]-(2-methylphenyl)methanone
SMILESCc1ccccc1C(=O)c1cc(-c2cccc(-n3c4ccccc4c4ccccc43)c2)ccc1C
InChIInChI=1S/C33H25NO/c1-22-10-3-4-13-27(22)33(35)30-21-25(19-18-23(30)2)24-11-9-12-26(20-24)34-31-16-7-5-14-28(31)29-15-6-8-17-32(29)34/h3-21H,1-2H3
InChIKeyUIYWTJSDEDBGFV-UHFFFAOYSA-N
MW451.57 g/mol
LogP8.30
Rot. Bonds4

About [5-(3-carbazol-9-ylphenyl)-2-methylphenyl]-(2-methylphenyl)methanone

[5-(3-carbazol-9-ylphenyl)-2-methylphenyl]-(2-methylphenyl)methanone (PubChem CID 145157854) has the molecular formula C33H25NO and a molecular weight of 451.57 g/mol. Its IUPAC name is [5-(3-carbazol-9-ylphenyl)-2-methylphenyl]-(2-methylphenyl)methanone.

Molecular Properties

Compound Name[5-(3-carbazol-9-ylphenyl)-2-methylphenyl]-(2-methylphenyl)methanone
PubChem CID145157854
Molecular FormulaC33H25NO
Molecular Weight451.57 g/mol
Exact Mass451.19
IUPAC Name[5-(3-carbazol-9-ylphenyl)-2-methylphenyl]-(2-methylphenyl)methanone
SMILESCc1ccccc1C(=O)c1cc(-c2cccc(-n3c4ccccc4c4ccccc43)c2)ccc1C
InChIInChI=1S/C33H25NO/c1-22-10-3-4-13-27(22)33(35)30-21-25(19-18-23(30)2)24-11-9-12-26(20-24)34-31-16-7-5-14-28(31)29-15-6-8-17-32(29)34/h3-21H,1-2H3
InChIKeyUIYWTJSDEDBGFV-UHFFFAOYSA-N
XLogP8.30
TPSA22.00 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms35
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500451.57
LogP ≤ 58.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

9-[3-[4-[4-[4-(3-carbazol-9-ylphenyl)phenyl]phenyl]phenyl]phenyl]carbazole
CID 118041263
9-[3-(3-carbazol-9-ylphenyl)phenyl]carbazole
CID 23386664
9-[3-[3-(3-carbazol-9-ylphenyl)-5-methylphenyl]phenyl]carbazole
CID 59841971
9-[3-[3,6-bis(3-carbazol-9-ylphenyl)carbazol-9-yl]phenyl]-3,6-bis(3-carbazol-9-ylphenyl)carbazole
CID 153162679
3,9-diphenyl-6-[9-(3-phenylphenyl)carbazol-3-yl]carbazole
CID 118449494
9-(3-triphenylen-2-ylphenyl)carbazole
CID 88924379
3-[3-(4-methylphenyl)phenyl]-9-(3-phenylphenyl)carbazole
CID 144639934
3-[9-[3-[4-(3,5-dimethylphenyl)phenyl]phenyl]carbazol-3-yl]-9-phenylcarbazole
CID 134370607
9-[3-[3-[3-[3-[3-[3-(3-phenylphenyl)phenyl]-5-[3-[4-(3-phenylphenyl)phenyl]phenyl]phenyl]phenyl]phenyl]phenyl]phenyl]-3-[9-[3-[3-[3-[3-[3-[3-(3-phenylphenyl)phenyl]-5-[3-[4-(3-phenylphenyl)phenyl]phenyl]phenyl]phenyl]phenyl]phenyl]phenyl]carbazol-3-yl]carbazole
CID 167244726
3-(9-phenylcarbazol-3-yl)-9-[3-(4-phenylphenyl)phenyl]carbazole;3-(9-phenylcarbazol-3-yl)-9-[4-(4-phenylphenyl)phenyl]carbazole
CID 161279377
3-[9-(3-phenylphenyl)carbazol-3-yl]-9-[3-(4-phenylphenyl)phenyl]carbazole;3-[9-(3-phenylphenyl)carbazol-3-yl]-9-[4-(4-phenylphenyl)phenyl]carbazole
CID 161418420
9-(3-phenylphenyl)-3-[9-(4-phenylphenyl)carbazol-3-yl]carbazole
CID 118014168

Frequently Asked Questions

What is the IUPAC name of [5-(3-carbazol-9-ylphenyl)-2-methylphenyl]-(2-methylphenyl)methanone?
The IUPAC name of [5-(3-carbazol-9-ylphenyl)-2-methylphenyl]-(2-methylphenyl)methanone (CID 145157854) is [5-(3-carbazol-9-ylphenyl)-2-methylphenyl]-(2-methylphenyl)methanone.
What is the SMILES notation for [5-(3-carbazol-9-ylphenyl)-2-methylphenyl]-(2-methylphenyl)methanone?
The canonical SMILES for [5-(3-carbazol-9-ylphenyl)-2-methylphenyl]-(2-methylphenyl)methanone is Cc1ccccc1C(=O)c1cc(-c2cccc(-n3c4ccccc4c4ccccc43)c2)ccc1C.
What is the InChIKey of [5-(3-carbazol-9-ylphenyl)-2-methylphenyl]-(2-methylphenyl)methanone?
The InChIKey is UIYWTJSDEDBGFV-UHFFFAOYSA-N. The full InChI is InChI=1S/C33H25NO/c1-22-10-3-4-13-27(22)33(35)30-21-25(19-18-23(30)2)24-11-9-12-26(20-24)34-31-16-7-5-14-28(31)29-15-6-8-17-32(29)34/h3-21H,1-2H3.
What are the key properties of [5-(3-carbazol-9-ylphenyl)-2-methylphenyl]-(2-methylphenyl)methanone?
[5-(3-carbazol-9-ylphenyl)-2-methylphenyl]-(2-methylphenyl)methanone has a molecular weight of 451.57 g/mol, XLogP of 8.30, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [5-(3-carbazol-9-ylphenyl)-2-methylphenyl]-(2-methylphenyl)methanone is sourced from PubChem (CID 145157854), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).