6-methoxy-2,4-bis(phenylmethoxy)quinazoline

C23H20N2O3 — CID 18796746

IUPAC6-methoxy-2,4-bis(phenylmethoxy)quinazoline
SMILESCOc1ccc2nc(OCc3ccccc3)nc(OCc3ccccc3)c2c1
InChIInChI=1S/C23H20N2O3/c1-26-19-12-13-21-20(14-19)22(27-15-17-8-4-2-5-9-17)25-23(24-21)28-16-18-10-6-3-7-11-18/h2-14H,15-16H2,1H3
InChIKeyBVWVXKPKKZBMQG-UHFFFAOYSA-N
MW372.42 g/mol
LogP4.80
Rot. Bonds7

About 6-methoxy-2,4-bis(phenylmethoxy)quinazoline

6-methoxy-2,4-bis(phenylmethoxy)quinazoline (PubChem CID 18796746) has the molecular formula C23H20N2O3 and a molecular weight of 372.42 g/mol. Its IUPAC name is 6-methoxy-2,4-bis(phenylmethoxy)quinazoline.

Molecular Properties

Compound Name6-methoxy-2,4-bis(phenylmethoxy)quinazoline
PubChem CID18796746
Molecular FormulaC23H20N2O3
Molecular Weight372.42 g/mol
Exact Mass372.15
IUPAC Name6-methoxy-2,4-bis(phenylmethoxy)quinazoline
SMILESCOc1ccc2nc(OCc3ccccc3)nc(OCc3ccccc3)c2c1
InChIInChI=1S/C23H20N2O3/c1-26-19-12-13-21-20(14-19)22(27-15-17-8-4-2-5-9-17)25-23(24-21)28-16-18-10-6-3-7-11-18/h2-14H,15-16H2,1H3
InChIKeyBVWVXKPKKZBMQG-UHFFFAOYSA-N
XLogP4.80
TPSA53.47 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500372.42
LogP ≤ 54.80
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 6-methoxy-2,4-bis(phenylmethoxy)quinazoline?
The IUPAC name of 6-methoxy-2,4-bis(phenylmethoxy)quinazoline (CID 18796746) is 6-methoxy-2,4-bis(phenylmethoxy)quinazoline.
What is the SMILES notation for 6-methoxy-2,4-bis(phenylmethoxy)quinazoline?
The canonical SMILES for 6-methoxy-2,4-bis(phenylmethoxy)quinazoline is COc1ccc2nc(OCc3ccccc3)nc(OCc3ccccc3)c2c1.
What is the InChIKey of 6-methoxy-2,4-bis(phenylmethoxy)quinazoline?
The InChIKey is BVWVXKPKKZBMQG-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H20N2O3/c1-26-19-12-13-21-20(14-19)22(27-15-17-8-4-2-5-9-17)25-23(24-21)28-16-18-10-6-3-7-11-18/h2-14H,15-16H2,1H3.
What are the key properties of 6-methoxy-2,4-bis(phenylmethoxy)quinazoline?
6-methoxy-2,4-bis(phenylmethoxy)quinazoline has a molecular weight of 372.42 g/mol, XLogP of 4.80, 7 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methoxy-2,4-bis(phenylmethoxy)quinazoline is sourced from PubChem (CID 18796746), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).