1-(4-methoxyphenyl)-2-phenyl-1-quinazolin-4-ylethanol

C23H20N2O2 — CID 10618249

IUPAC1-(4-methoxyphenyl)-2-phenyl-1-quinazolin-4-ylethanol
SMILESCOc1ccc(C(O)(Cc2ccccc2)c2ncnc3ccccc23)cc1
InChIInChI=1S/C23H20N2O2/c1-27-19-13-11-18(12-14-19)23(26,15-17-7-3-2-4-8-17)22-20-9-5-6-10-21(20)24-16-25-22/h2-14,16,26H,15H2,1H3
InChIKeyUPHWXBPODBZMAV-UHFFFAOYSA-N
MW356.43 g/mol
LogP4.12
Rot. Bonds5

About 1-(4-methoxyphenyl)-2-phenyl-1-quinazolin-4-ylethanol

1-(4-methoxyphenyl)-2-phenyl-1-quinazolin-4-ylethanol (PubChem CID 10618249) has the molecular formula C23H20N2O2 and a molecular weight of 356.43 g/mol. Its IUPAC name is 1-(4-methoxyphenyl)-2-phenyl-1-quinazolin-4-ylethanol.

Molecular Properties

Compound Name1-(4-methoxyphenyl)-2-phenyl-1-quinazolin-4-ylethanol
PubChem CID10618249
Molecular FormulaC23H20N2O2
Molecular Weight356.43 g/mol
Exact Mass356.15
IUPAC Name1-(4-methoxyphenyl)-2-phenyl-1-quinazolin-4-ylethanol
SMILESCOc1ccc(C(O)(Cc2ccccc2)c2ncnc3ccccc23)cc1
InChIInChI=1S/C23H20N2O2/c1-27-19-13-11-18(12-14-19)23(26,15-17-7-3-2-4-8-17)22-20-9-5-6-10-21(20)24-16-25-22/h2-14,16,26H,15H2,1H3
InChIKeyUPHWXBPODBZMAV-UHFFFAOYSA-N
XLogP4.12
TPSA55.24 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500356.43
LogP ≤ 54.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-(4-methoxyphenyl)-2-phenyl-1-quinazolin-4-ylethanol?
The IUPAC name of 1-(4-methoxyphenyl)-2-phenyl-1-quinazolin-4-ylethanol (CID 10618249) is 1-(4-methoxyphenyl)-2-phenyl-1-quinazolin-4-ylethanol.
What is the SMILES notation for 1-(4-methoxyphenyl)-2-phenyl-1-quinazolin-4-ylethanol?
The canonical SMILES for 1-(4-methoxyphenyl)-2-phenyl-1-quinazolin-4-ylethanol is COc1ccc(C(O)(Cc2ccccc2)c2ncnc3ccccc23)cc1.
What is the InChIKey of 1-(4-methoxyphenyl)-2-phenyl-1-quinazolin-4-ylethanol?
The InChIKey is UPHWXBPODBZMAV-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H20N2O2/c1-27-19-13-11-18(12-14-19)23(26,15-17-7-3-2-4-8-17)22-20-9-5-6-10-21(20)24-16-25-22/h2-14,16,26H,15H2,1H3.
What are the key properties of 1-(4-methoxyphenyl)-2-phenyl-1-quinazolin-4-ylethanol?
1-(4-methoxyphenyl)-2-phenyl-1-quinazolin-4-ylethanol has a molecular weight of 356.43 g/mol, XLogP of 4.12, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-methoxyphenyl)-2-phenyl-1-quinazolin-4-ylethanol is sourced from PubChem (CID 10618249), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).