1,3-diphenylnaphthalen-2-ol;1-methyl-2-naphthalen-1-ylnaphthalene;2-phenylnaphthalen-1-ol

C59H44O2 — CID 160917683

IUPAC1,3-diphenylnaphthalen-2-ol;1-methyl-2-naphthalen-1-ylnaphthalene;2-phenylnaphthalen-1-ol
SMILESCc1c(-c2cccc3ccccc23)ccc2ccccc12.Oc1c(-c2ccccc2)cc2ccccc2c1-c1ccccc1.Oc1c(-c2ccccc2)ccc2ccccc12
InChIInChI=1S/C22H16O.C21H16.C16H12O/c23-22-20(16-9-3-1-4-10-16)15-18-13-7-8-14-19(18)21(22)17-11-5-2-6-12-17;1-15-18-10-4-2-8-17(18)13-14-19(15)21-12-6-9-16-7-3-5-11-20(16)21;17-16-14-9-5-4-8-13(14)10-11-15(16)12-6-2-1-3-7-12/h1-15,23H;2-14H,1H3;1-11,17H
InChIKeySRPUXLWEVJIJQD-UHFFFAOYSA-N
MW785.00 g/mol
LogP16.06
Rot. Bonds4

About 1,3-diphenylnaphthalen-2-ol;1-methyl-2-naphthalen-1-ylnaphthalene;2-phenylnaphthalen-1-ol

1,3-diphenylnaphthalen-2-ol;1-methyl-2-naphthalen-1-ylnaphthalene;2-phenylnaphthalen-1-ol (PubChem CID 160917683) has the molecular formula C59H44O2 and a molecular weight of 785.00 g/mol. Its IUPAC name is 1,3-diphenylnaphthalen-2-ol;1-methyl-2-naphthalen-1-ylnaphthalene;2-phenylnaphthalen-1-ol.

Molecular Properties

Compound Name1,3-diphenylnaphthalen-2-ol;1-methyl-2-naphthalen-1-ylnaphthalene;2-phenylnaphthalen-1-ol
PubChem CID160917683
Molecular FormulaC59H44O2
Molecular Weight785.00 g/mol
Exact Mass784.33
IUPAC Name1,3-diphenylnaphthalen-2-ol;1-methyl-2-naphthalen-1-ylnaphthalene;2-phenylnaphthalen-1-ol
SMILESCc1c(-c2cccc3ccccc23)ccc2ccccc12.Oc1c(-c2ccccc2)cc2ccccc2c1-c1ccccc1.Oc1c(-c2ccccc2)ccc2ccccc12
InChIInChI=1S/C22H16O.C21H16.C16H12O/c23-22-20(16-9-3-1-4-10-16)15-18-13-7-8-14-19(18)21(22)17-11-5-2-6-12-17;1-15-18-10-4-2-8-17(18)13-14-19(15)21-12-6-9-16-7-3-5-11-20(16)21;17-16-14-9-5-4-8-13(14)10-11-15(16)12-6-2-1-3-7-12/h1-15,23H;2-14H,1H3;1-11,17H
InChIKeySRPUXLWEVJIJQD-UHFFFAOYSA-N
XLogP16.06
TPSA40.46 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms61
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500785.00
LogP ≤ 516.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 1,3-diphenylnaphthalen-2-ol;1-methyl-2-naphthalen-1-ylnaphthalene;2-phenylnaphthalen-1-ol 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

1-naphthalen-1-yl-3-phenylnaphthalen-2-ol
CID 11982733
2-methyl-1-[2-methyl-3-(1-methylnaphthalen-2-yl)naphthalen-1-yl]-3-(1-methylnaphthalen-2-yl)naphthalene
CID 123673434
dichlorotitanium;1-(2-hydroxy-3-phenylnaphthalen-1-yl)-3-phenylnaphthalen-2-ol
CID 58639284
9-(3-naphthalen-1-ylphenyl)-10-[4-(1-phenylnaphthalen-2-yl)phenyl]anthracene
CID 59413134
2-phenylanthracen-1-ol
CID 54315343
9-[1-(4-naphthalen-1-ylphenyl)naphthalen-2-yl]anthracene
CID 140565979
9-[8-(4-naphthalen-1-ylphenyl)naphthalen-2-yl]-10-phenylanthracene
CID 144837308
1,2-diphenylnaphthalene
CID 11208267
18,19-diphenylpentacyclo[10.7.1.02,11.03,8.016,20]icosa-1(20),2(11),3,5,7,9,12,14,16,18-decaene
CID 140529722
9-[8-(4-methylphenyl)naphthalen-2-yl]-10-phenylanthracene
CID 144837262
3-methyl-2-phenylnaphthalen-1-ol
CID 68536757
9-naphthalen-2-yl-10-(4-naphthalen-1-yl-3-phenylphenyl)anthracene
CID 58856517

Frequently Asked Questions

What is the IUPAC name of 1,3-diphenylnaphthalen-2-ol;1-methyl-2-naphthalen-1-ylnaphthalene;2-phenylnaphthalen-1-ol?
The IUPAC name of 1,3-diphenylnaphthalen-2-ol;1-methyl-2-naphthalen-1-ylnaphthalene;2-phenylnaphthalen-1-ol (CID 160917683) is 1,3-diphenylnaphthalen-2-ol;1-methyl-2-naphthalen-1-ylnaphthalene;2-phenylnaphthalen-1-ol.
What is the SMILES notation for 1,3-diphenylnaphthalen-2-ol;1-methyl-2-naphthalen-1-ylnaphthalene;2-phenylnaphthalen-1-ol?
The canonical SMILES for 1,3-diphenylnaphthalen-2-ol;1-methyl-2-naphthalen-1-ylnaphthalene;2-phenylnaphthalen-1-ol is Cc1c(-c2cccc3ccccc23)ccc2ccccc12.Oc1c(-c2ccccc2)cc2ccccc2c1-c1ccccc1.Oc1c(-c2ccccc2)ccc2ccccc12.
What is the InChIKey of 1,3-diphenylnaphthalen-2-ol;1-methyl-2-naphthalen-1-ylnaphthalene;2-phenylnaphthalen-1-ol?
The InChIKey is SRPUXLWEVJIJQD-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H16O.C21H16.C16H12O/c23-22-20(16-9-3-1-4-10-16)15-18-13-7-8-14-19(18)21(22)17-11-5-2-6-12-17;1-15-18-10-4-2-8-17(18)13-14-19(15)21-12-6-9-16-7-3-5-11-20(16)21;17-16-14-9-5-4-8-13(14)10-11-15(16)12-6-2-1-3-7-12/h1-15,23H;2-14H,1H3;1-11,17H.
What are the key properties of 1,3-diphenylnaphthalen-2-ol;1-methyl-2-naphthalen-1-ylnaphthalene;2-phenylnaphthalen-1-ol?
1,3-diphenylnaphthalen-2-ol;1-methyl-2-naphthalen-1-ylnaphthalene;2-phenylnaphthalen-1-ol has a molecular weight of 785.00 g/mol, XLogP of 16.06, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1,3-diphenylnaphthalen-2-ol;1-methyl-2-naphthalen-1-ylnaphthalene;2-phenylnaphthalen-1-ol is sourced from PubChem (CID 160917683), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).