7-bromo-2,4-dichloro-6-methoxyquinazoline

C9H5BrCl2N2O — CID 155682427

IUPAC7-bromo-2,4-dichloro-6-methoxyquinazoline
SMILESCOc1cc2c(Cl)nc(Cl)nc2cc1Br
InChIInChI=1S/C9H5BrCl2N2O/c1-15-7-2-4-6(3-5(7)10)13-9(12)14-8(4)11/h2-3H,1H3
InChIKeyHYJASKWVEZMAHI-UHFFFAOYSA-N
MW307.96 g/mol
LogP3.71
Rot. Bonds1

About 7-bromo-2,4-dichloro-6-methoxyquinazoline

7-bromo-2,4-dichloro-6-methoxyquinazoline (PubChem CID 155682427) has the molecular formula C9H5BrCl2N2O and a molecular weight of 307.96 g/mol. Its IUPAC name is 7-bromo-2,4-dichloro-6-methoxyquinazoline.

Molecular Properties

Compound Name7-bromo-2,4-dichloro-6-methoxyquinazoline
PubChem CID155682427
Molecular FormulaC9H5BrCl2N2O
Molecular Weight307.96 g/mol
Exact Mass305.90
IUPAC Name7-bromo-2,4-dichloro-6-methoxyquinazoline
SMILESCOc1cc2c(Cl)nc(Cl)nc2cc1Br
InChIInChI=1S/C9H5BrCl2N2O/c1-15-7-2-4-6(3-5(7)10)13-9(12)14-8(4)11/h2-3H,1H3
InChIKeyHYJASKWVEZMAHI-UHFFFAOYSA-N
XLogP3.71
TPSA35.01 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.96
LogP ≤ 53.71
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

7-bromo-2,4-dichloro-6-methoxyquinoline
CID 171506609
2,4-dichloro-6-methoxy-7-propoxyquinazoline
CID 21330888
6-bromo-2,4,7-trichloroquinazoline
CID 45379709
CID 90466532
CID 90466532
7-bromo-5-chloro-8-methoxy-2,3-dihydro-1H-cyclopenta[c]isoquinoline
CID 87535501
4-chloro-6,7-dimethoxy-2-methylsulfanylquinazoline
CID 114693063
4-chloro-6,7-dimethoxy-2-(trifluoromethyl)quinazoline
CID 22693550
2-bromo-4-chloro-6,7-dimethoxyquinoline
CID 139329626
4-chloro-2-(2-chloroethyl)-6,7-dimethoxyquinazoline
CID 90236933
6-bromo-5-methoxy-3-methyl-2H-indazole
CID 176567040
4-chloro-6,7-dimethoxy-2-(3-methoxyphenyl)quinazoline
CID 57328585
1,4-dibromo-2-chloro-5-methoxybenzene
CID 50997851

Frequently Asked Questions

What is the IUPAC name of 7-bromo-2,4-dichloro-6-methoxyquinazoline?
The IUPAC name of 7-bromo-2,4-dichloro-6-methoxyquinazoline (CID 155682427) is 7-bromo-2,4-dichloro-6-methoxyquinazoline.
What is the SMILES notation for 7-bromo-2,4-dichloro-6-methoxyquinazoline?
The canonical SMILES for 7-bromo-2,4-dichloro-6-methoxyquinazoline is COc1cc2c(Cl)nc(Cl)nc2cc1Br.
What is the InChIKey of 7-bromo-2,4-dichloro-6-methoxyquinazoline?
The InChIKey is HYJASKWVEZMAHI-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H5BrCl2N2O/c1-15-7-2-4-6(3-5(7)10)13-9(12)14-8(4)11/h2-3H,1H3.
What are the key properties of 7-bromo-2,4-dichloro-6-methoxyquinazoline?
7-bromo-2,4-dichloro-6-methoxyquinazoline has a molecular weight of 307.96 g/mol, XLogP of 3.71, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 7-bromo-2,4-dichloro-6-methoxyquinazoline is sourced from PubChem (CID 155682427), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).