5-bromo-4-chloro-2-ethyl-8-methoxyquinazoline

C11H10BrClN2O — CID 114591397

IUPAC5-bromo-4-chloro-2-ethyl-8-methoxyquinazoline
SMILESCCc1nc(Cl)c2c(Br)ccc(OC)c2n1
InChIInChI=1S/C11H10BrClN2O/c1-3-8-14-10-7(16-2)5-4-6(12)9(10)11(13)15-8/h4-5H,3H2,1-2H3
InChIKeyJEVQMMYAISBLJM-UHFFFAOYSA-N
MW301.57 g/mol
LogP3.62
Rot. Bonds2

About 5-bromo-4-chloro-2-ethyl-8-methoxyquinazoline

5-bromo-4-chloro-2-ethyl-8-methoxyquinazoline (PubChem CID 114591397) has the molecular formula C11H10BrClN2O and a molecular weight of 301.57 g/mol. Its IUPAC name is 5-bromo-4-chloro-2-ethyl-8-methoxyquinazoline.

Molecular Properties

Compound Name5-bromo-4-chloro-2-ethyl-8-methoxyquinazoline
PubChem CID114591397
Molecular FormulaC11H10BrClN2O
Molecular Weight301.57 g/mol
Exact Mass299.97
IUPAC Name5-bromo-4-chloro-2-ethyl-8-methoxyquinazoline
SMILESCCc1nc(Cl)c2c(Br)ccc(OC)c2n1
InChIInChI=1S/C11H10BrClN2O/c1-3-8-14-10-7(16-2)5-4-6(12)9(10)11(13)15-8/h4-5H,3H2,1-2H3
InChIKeyJEVQMMYAISBLJM-UHFFFAOYSA-N
XLogP3.62
TPSA35.01 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.57
LogP ≤ 53.62
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

5-bromo-4-chloro-2-(3-chloro-4-methylthiophen-2-yl)-8-methoxyquinazoline
CID 103400565
5-bromo-4-chloro-2-ethyl-7-methoxyquinazoline
CID 114591753
5-bromo-3-ethyl-8-methoxy-N,2-dimethylquinolin-4-amine
CID 63483485
5-bromo-N,2-diethyl-8-methoxy-3-methylquinolin-4-amine
CID 55222432
3,5-dibromo-4-chloro-8-methoxyquinoline
CID 114759895
8-bromo-9-chloro-5-methoxy-2,3-dihydro-1H-cyclopenta[b]quinoline
CID 54967603
5-bromo-8-methoxy-2-propylquinolin-4-amine
CID 55211682
5-bromo-8-methoxy-2-methylquinolin-4-amine
CID 62196790
3,4-dibromo-7-methoxy-2H-indazole
CID 114589251
5-bromo-2-cyclopropyl-N-ethyl-8-methoxyquinolin-4-amine
CID 63481850
2,8-dichloro-3-ethyl-5-methoxyquinoline
CID 63232145
6-chloro-2-ethyl-N-(2-methoxy-5-methylphenyl)-5-methylpyrimidin-4-amine
CID 80974359

Frequently Asked Questions

What is the IUPAC name of 5-bromo-4-chloro-2-ethyl-8-methoxyquinazoline?
The IUPAC name of 5-bromo-4-chloro-2-ethyl-8-methoxyquinazoline (CID 114591397) is 5-bromo-4-chloro-2-ethyl-8-methoxyquinazoline.
What is the SMILES notation for 5-bromo-4-chloro-2-ethyl-8-methoxyquinazoline?
The canonical SMILES for 5-bromo-4-chloro-2-ethyl-8-methoxyquinazoline is CCc1nc(Cl)c2c(Br)ccc(OC)c2n1.
What is the InChIKey of 5-bromo-4-chloro-2-ethyl-8-methoxyquinazoline?
The InChIKey is JEVQMMYAISBLJM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10BrClN2O/c1-3-8-14-10-7(16-2)5-4-6(12)9(10)11(13)15-8/h4-5H,3H2,1-2H3.
What are the key properties of 5-bromo-4-chloro-2-ethyl-8-methoxyquinazoline?
5-bromo-4-chloro-2-ethyl-8-methoxyquinazoline has a molecular weight of 301.57 g/mol, XLogP of 3.62, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-4-chloro-2-ethyl-8-methoxyquinazoline is sourced from PubChem (CID 114591397), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).