4,6-dichloro-2-(2-methoxyphenyl)quinazoline

C15H10Cl2N2O — CID 63084991

IUPAC4,6-dichloro-2-(2-methoxyphenyl)quinazoline
SMILESCOc1ccccc1-c1nc(Cl)c2cc(Cl)ccc2n1
InChIInChI=1S/C15H10Cl2N2O/c1-20-13-5-3-2-4-10(13)15-18-12-7-6-9(16)8-11(12)14(17)19-15/h2-8H,1H3
InChIKeyKCLNHVPJOOPUGJ-UHFFFAOYSA-N
MW305.16 g/mol
LogP4.61
Rot. Bonds2

About 4,6-dichloro-2-(2-methoxyphenyl)quinazoline

4,6-dichloro-2-(2-methoxyphenyl)quinazoline (PubChem CID 63084991) has the molecular formula C15H10Cl2N2O and a molecular weight of 305.16 g/mol. Its IUPAC name is 4,6-dichloro-2-(2-methoxyphenyl)quinazoline.

Molecular Properties

Compound Name4,6-dichloro-2-(2-methoxyphenyl)quinazoline
PubChem CID63084991
Molecular FormulaC15H10Cl2N2O
Molecular Weight305.16 g/mol
Exact Mass304.02
IUPAC Name4,6-dichloro-2-(2-methoxyphenyl)quinazoline
SMILESCOc1ccccc1-c1nc(Cl)c2cc(Cl)ccc2n1
InChIInChI=1S/C15H10Cl2N2O/c1-20-13-5-3-2-4-10(13)15-18-12-7-6-9(16)8-11(12)14(17)19-15/h2-8H,1H3
InChIKeyKCLNHVPJOOPUGJ-UHFFFAOYSA-N
XLogP4.61
TPSA35.01 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.16
LogP ≤ 54.61
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4,6-dichloro-2-(2-methoxyphenyl)quinazoline?
The IUPAC name of 4,6-dichloro-2-(2-methoxyphenyl)quinazoline (CID 63084991) is 4,6-dichloro-2-(2-methoxyphenyl)quinazoline.
What is the SMILES notation for 4,6-dichloro-2-(2-methoxyphenyl)quinazoline?
The canonical SMILES for 4,6-dichloro-2-(2-methoxyphenyl)quinazoline is COc1ccccc1-c1nc(Cl)c2cc(Cl)ccc2n1.
What is the InChIKey of 4,6-dichloro-2-(2-methoxyphenyl)quinazoline?
The InChIKey is KCLNHVPJOOPUGJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H10Cl2N2O/c1-20-13-5-3-2-4-10(13)15-18-12-7-6-9(16)8-11(12)14(17)19-15/h2-8H,1H3.
What are the key properties of 4,6-dichloro-2-(2-methoxyphenyl)quinazoline?
4,6-dichloro-2-(2-methoxyphenyl)quinazoline has a molecular weight of 305.16 g/mol, XLogP of 4.61, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4,6-dichloro-2-(2-methoxyphenyl)quinazoline is sourced from PubChem (CID 63084991), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).