7-methoxy-3,4-diphenylnaphthalen-2-ol

C23H18O2 — CID 170563506

IUPAC7-methoxy-3,4-diphenylnaphthalen-2-ol
SMILESCOc1ccc2c(-c3ccccc3)c(-c3ccccc3)c(O)cc2c1
InChIInChI=1S/C23H18O2/c1-25-19-12-13-20-18(14-19)15-21(24)23(17-10-6-3-7-11-17)22(20)16-8-4-2-5-9-16/h2-15,24H,1H3
InChIKeyKAFZHTMKKZTWGX-UHFFFAOYSA-N
MW326.40 g/mol
LogP5.89
Rot. Bonds3

About 7-methoxy-3,4-diphenylnaphthalen-2-ol

7-methoxy-3,4-diphenylnaphthalen-2-ol (PubChem CID 170563506) has the molecular formula C23H18O2 and a molecular weight of 326.40 g/mol. Its IUPAC name is 7-methoxy-3,4-diphenylnaphthalen-2-ol.

Molecular Properties

Compound Name7-methoxy-3,4-diphenylnaphthalen-2-ol
PubChem CID170563506
Molecular FormulaC23H18O2
Molecular Weight326.40 g/mol
Exact Mass326.13
IUPAC Name7-methoxy-3,4-diphenylnaphthalen-2-ol
SMILESCOc1ccc2c(-c3ccccc3)c(-c3ccccc3)c(O)cc2c1
InChIInChI=1S/C23H18O2/c1-25-19-12-13-20-18(14-19)15-21(24)23(17-10-6-3-7-11-17)22(20)16-8-4-2-5-9-16/h2-15,24H,1H3
InChIKeyKAFZHTMKKZTWGX-UHFFFAOYSA-N
XLogP5.89
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms25
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500326.40
LogP ≤ 55.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 7-methoxy-3,4-diphenylnaphthalen-2-ol?
The IUPAC name of 7-methoxy-3,4-diphenylnaphthalen-2-ol (CID 170563506) is 7-methoxy-3,4-diphenylnaphthalen-2-ol.
What is the SMILES notation for 7-methoxy-3,4-diphenylnaphthalen-2-ol?
The canonical SMILES for 7-methoxy-3,4-diphenylnaphthalen-2-ol is COc1ccc2c(-c3ccccc3)c(-c3ccccc3)c(O)cc2c1.
What is the InChIKey of 7-methoxy-3,4-diphenylnaphthalen-2-ol?
The InChIKey is KAFZHTMKKZTWGX-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H18O2/c1-25-19-12-13-20-18(14-19)15-21(24)23(17-10-6-3-7-11-17)22(20)16-8-4-2-5-9-16/h2-15,24H,1H3.
What are the key properties of 7-methoxy-3,4-diphenylnaphthalen-2-ol?
7-methoxy-3,4-diphenylnaphthalen-2-ol has a molecular weight of 326.40 g/mol, XLogP of 5.89, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 7-methoxy-3,4-diphenylnaphthalen-2-ol is sourced from PubChem (CID 170563506), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).