7-bromo-4-chloro-2-(2,4-dichlorophenyl)-8-methylquinazoline

C15H8BrCl3N2 — CID 114591566

IUPAC7-bromo-4-chloro-2-(2,4-dichlorophenyl)-8-methylquinazoline
SMILESCc1c(Br)ccc2c(Cl)nc(-c3ccc(Cl)cc3Cl)nc12
InChIInChI=1S/C15H8BrCl3N2/c1-7-11(16)5-4-10-13(7)20-15(21-14(10)19)9-3-2-8(17)6-12(9)18/h2-6H,1H3
InChIKeyZOMBJGVDAYSYRG-UHFFFAOYSA-N
MW402.51 g/mol
LogP6.33
Rot. Bonds1

About 7-bromo-4-chloro-2-(2,4-dichlorophenyl)-8-methylquinazoline

7-bromo-4-chloro-2-(2,4-dichlorophenyl)-8-methylquinazoline (PubChem CID 114591566) has the molecular formula C15H8BrCl3N2 and a molecular weight of 402.51 g/mol. Its IUPAC name is 7-bromo-4-chloro-2-(2,4-dichlorophenyl)-8-methylquinazoline.

Molecular Properties

Compound Name7-bromo-4-chloro-2-(2,4-dichlorophenyl)-8-methylquinazoline
PubChem CID114591566
Molecular FormulaC15H8BrCl3N2
Molecular Weight402.51 g/mol
Exact Mass399.89
IUPAC Name7-bromo-4-chloro-2-(2,4-dichlorophenyl)-8-methylquinazoline
SMILESCc1c(Br)ccc2c(Cl)nc(-c3ccc(Cl)cc3Cl)nc12
InChIInChI=1S/C15H8BrCl3N2/c1-7-11(16)5-4-10-13(7)20-15(21-14(10)19)9-3-2-8(17)6-12(9)18/h2-6H,1H3
InChIKeyZOMBJGVDAYSYRG-UHFFFAOYSA-N
XLogP6.33
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500402.51
LogP ≤ 56.33
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

7-bromo-4-chloro-2-(2-chloro-3-methylphenyl)-8-methylquinazoline
CID 114591569
2-(5-bromo-2-chlorophenyl)-4-chloro-7-fluoro-8-methylquinazoline
CID 114591476
7-bromo-4-chloro-2-(4-methoxyphenyl)-8-methylquinazoline
CID 114591533
2-(4-bromo-2-chlorophenyl)-4,6,8-trichloroquinazoline
CID 63496793
6-bromo-4-chloro-2-(2-chloro-4-methylphenyl)-8-fluoroquinazoline
CID 106860939
4,7-dichloro-2-(2-fluoro-4-methylphenyl)-8-methylquinazoline
CID 114589505
6,8-dibromo-4-chloro-2-(5-chloro-2-methylphenyl)quinazoline
CID 82870561
7-bromo-4-chloro-8-methyl-2-thieno[3,2-b]thiophen-5-ylquinazoline
CID 114591559
4,6,8-trichloro-2-(5-chloro-2-methylphenyl)quinazoline
CID 82870560
4,6-dichloro-2-(2,4-dichlorophenyl)-5-propan-2-ylpyrimidine
CID 63612507
4-chloro-2-(2-chloro-4-methylphenyl)-8-methylquinazoline
CID 106860907
8-bromo-4-chloro-2-(2,4-dimethylphenyl)-6-methylquinazoline
CID 114589664

Frequently Asked Questions

What is the IUPAC name of 7-bromo-4-chloro-2-(2,4-dichlorophenyl)-8-methylquinazoline?
The IUPAC name of 7-bromo-4-chloro-2-(2,4-dichlorophenyl)-8-methylquinazoline (CID 114591566) is 7-bromo-4-chloro-2-(2,4-dichlorophenyl)-8-methylquinazoline.
What is the SMILES notation for 7-bromo-4-chloro-2-(2,4-dichlorophenyl)-8-methylquinazoline?
The canonical SMILES for 7-bromo-4-chloro-2-(2,4-dichlorophenyl)-8-methylquinazoline is Cc1c(Br)ccc2c(Cl)nc(-c3ccc(Cl)cc3Cl)nc12.
What is the InChIKey of 7-bromo-4-chloro-2-(2,4-dichlorophenyl)-8-methylquinazoline?
The InChIKey is ZOMBJGVDAYSYRG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H8BrCl3N2/c1-7-11(16)5-4-10-13(7)20-15(21-14(10)19)9-3-2-8(17)6-12(9)18/h2-6H,1H3.
What are the key properties of 7-bromo-4-chloro-2-(2,4-dichlorophenyl)-8-methylquinazoline?
7-bromo-4-chloro-2-(2,4-dichlorophenyl)-8-methylquinazoline has a molecular weight of 402.51 g/mol, XLogP of 6.33, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 7-bromo-4-chloro-2-(2,4-dichlorophenyl)-8-methylquinazoline is sourced from PubChem (CID 114591566), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).