8-bromo-4-chloro-6-methyl-2-propylquinazoline

C12H12BrClN2 — CID 106584204

IUPAC8-bromo-4-chloro-6-methyl-2-propylquinazoline
SMILESCCCc1nc(Cl)c2cc(C)cc(Br)c2n1
InChIInChI=1S/C12H12BrClN2/c1-3-4-10-15-11-8(12(14)16-10)5-7(2)6-9(11)13/h5-6H,3-4H2,1-2H3
InChIKeyUBMILRIOXGHWRB-UHFFFAOYSA-N
MW299.60 g/mol
LogP4.31
Rot. Bonds2

About 8-bromo-4-chloro-6-methyl-2-propylquinazoline

8-bromo-4-chloro-6-methyl-2-propylquinazoline (PubChem CID 106584204) has the molecular formula C12H12BrClN2 and a molecular weight of 299.60 g/mol. Its IUPAC name is 8-bromo-4-chloro-6-methyl-2-propylquinazoline.

Molecular Properties

Compound Name8-bromo-4-chloro-6-methyl-2-propylquinazoline
PubChem CID106584204
Molecular FormulaC12H12BrClN2
Molecular Weight299.60 g/mol
Exact Mass297.99
IUPAC Name8-bromo-4-chloro-6-methyl-2-propylquinazoline
SMILESCCCc1nc(Cl)c2cc(C)cc(Br)c2n1
InChIInChI=1S/C12H12BrClN2/c1-3-4-10-15-11-8(12(14)16-10)5-7(2)6-9(11)13/h5-6H,3-4H2,1-2H3
InChIKeyUBMILRIOXGHWRB-UHFFFAOYSA-N
XLogP4.31
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.60
LogP ≤ 54.31
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

8-bromo-4,6-dichloro-2-propylquinazoline
CID 106583968
(8-bromo-4-chloro-6-methylquinazolin-2-yl)methanol
CID 174656084
2-(8-bromo-4-chloroquinazolin-2-yl)ethanamine
CID 84813864
8-bromo-4-chloro-2-(2,4-dimethylphenyl)-6-methylquinazoline
CID 114589664
4-bromo-6-chloro-8-fluoro-2-propylquinazoline
CID 106584157
5-bromo-4-chloro-6-methyl-2-propylpyrimidine
CID 66293537
4,8-dibromo-3-chloro-2,6-dimethylquinoline
CID 121236438
8-bromo-4-chloro-2-(2,3-difluorophenyl)-6-methylquinazoline
CID 114589638
8-bromo-4-chloro-2-(3-chloro-2-fluorophenyl)-6-methylquinazoline
CID 114589644
4-chloro-6-[(3,5-dimethylphenyl)methylsulfanyl]-5-methyl-2-propylpyrimidine
CID 80971056
4-(3-bromophenyl)sulfanyl-6-chloro-5-methyl-2-propylpyrimidine
CID 80978438
5-bromo-2-chloro-8-fluoro-3-propylquinoline
CID 63530205

Frequently Asked Questions

What is the IUPAC name of 8-bromo-4-chloro-6-methyl-2-propylquinazoline?
The IUPAC name of 8-bromo-4-chloro-6-methyl-2-propylquinazoline (CID 106584204) is 8-bromo-4-chloro-6-methyl-2-propylquinazoline.
What is the SMILES notation for 8-bromo-4-chloro-6-methyl-2-propylquinazoline?
The canonical SMILES for 8-bromo-4-chloro-6-methyl-2-propylquinazoline is CCCc1nc(Cl)c2cc(C)cc(Br)c2n1.
What is the InChIKey of 8-bromo-4-chloro-6-methyl-2-propylquinazoline?
The InChIKey is UBMILRIOXGHWRB-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H12BrClN2/c1-3-4-10-15-11-8(12(14)16-10)5-7(2)6-9(11)13/h5-6H,3-4H2,1-2H3.
What are the key properties of 8-bromo-4-chloro-6-methyl-2-propylquinazoline?
8-bromo-4-chloro-6-methyl-2-propylquinazoline has a molecular weight of 299.60 g/mol, XLogP of 4.31, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 8-bromo-4-chloro-6-methyl-2-propylquinazoline is sourced from PubChem (CID 106584204), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).