4-chloro-2-(2-chlorophenyl)-7-fluoro-6-methylquinazoline

C15H9Cl2FN2 — CID 114591625

IUPAC4-chloro-2-(2-chlorophenyl)-7-fluoro-6-methylquinazoline
SMILESCc1cc2c(Cl)nc(-c3ccccc3Cl)nc2cc1F
InChIInChI=1S/C15H9Cl2FN2/c1-8-6-10-13(7-12(8)18)19-15(20-14(10)17)9-4-2-3-5-11(9)16/h2-7H,1H3
InChIKeyOMMOFQBJRIQNFW-UHFFFAOYSA-N
MW307.16 g/mol
LogP5.05
Rot. Bonds1

About 4-chloro-2-(2-chlorophenyl)-7-fluoro-6-methylquinazoline

4-chloro-2-(2-chlorophenyl)-7-fluoro-6-methylquinazoline (PubChem CID 114591625) has the molecular formula C15H9Cl2FN2 and a molecular weight of 307.16 g/mol. Its IUPAC name is 4-chloro-2-(2-chlorophenyl)-7-fluoro-6-methylquinazoline.

Molecular Properties

Compound Name4-chloro-2-(2-chlorophenyl)-7-fluoro-6-methylquinazoline
PubChem CID114591625
Molecular FormulaC15H9Cl2FN2
Molecular Weight307.16 g/mol
Exact Mass306.01
IUPAC Name4-chloro-2-(2-chlorophenyl)-7-fluoro-6-methylquinazoline
SMILESCc1cc2c(Cl)nc(-c3ccccc3Cl)nc2cc1F
InChIInChI=1S/C15H9Cl2FN2/c1-8-6-10-13(7-12(8)18)19-15(20-14(10)17)9-4-2-3-5-11(9)16/h2-7H,1H3
InChIKeyOMMOFQBJRIQNFW-UHFFFAOYSA-N
XLogP5.05
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500307.16
LogP ≤ 55.05
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

4-chloro-7-fluoro-6-methyl-2-phenylquinazoline
CID 114591614
4-chloro-2-(2,6-difluorophenyl)-7-fluoro-6-methylquinazoline
CID 114591658
6-bromo-4-chloro-7-fluoro-2-(2-fluoro-3-methylphenyl)quinazoline
CID 114591270
2-(2-chlorophenyl)-7-fluoro-4-methylquinazoline
CID 141298320
4-chloro-7-fluoro-2-(2-methylphenyl)quinazoline
CID 63083992
4-chloro-7-fluoro-2-(3-fluoro-5-methylphenyl)-6-methylquinazoline
CID 114591652
4,6-dichloro-2-(2-chlorophenyl)-5-fluoropyrimidine
CID 80550476
2,4-dichloro-6-fluoro-7-methylquinazoline
CID 167510683
4-chloro-2-(2-chlorophenyl)-6-propylquinazoline
CID 114590720
2-(2-chlorophenyl)-7-fluoroquinazolin-4-amine
CID 64983741
4-chloro-2-(3-chlorophenyl)-6,7-difluoroquinazoline
CID 114590146
4-chloro-6-fluoro-2-(5-fluoro-2-methylphenyl)quinazoline
CID 63085513

Frequently Asked Questions

What is the IUPAC name of 4-chloro-2-(2-chlorophenyl)-7-fluoro-6-methylquinazoline?
The IUPAC name of 4-chloro-2-(2-chlorophenyl)-7-fluoro-6-methylquinazoline (CID 114591625) is 4-chloro-2-(2-chlorophenyl)-7-fluoro-6-methylquinazoline.
What is the SMILES notation for 4-chloro-2-(2-chlorophenyl)-7-fluoro-6-methylquinazoline?
The canonical SMILES for 4-chloro-2-(2-chlorophenyl)-7-fluoro-6-methylquinazoline is Cc1cc2c(Cl)nc(-c3ccccc3Cl)nc2cc1F.
What is the InChIKey of 4-chloro-2-(2-chlorophenyl)-7-fluoro-6-methylquinazoline?
The InChIKey is OMMOFQBJRIQNFW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H9Cl2FN2/c1-8-6-10-13(7-12(8)18)19-15(20-14(10)17)9-4-2-3-5-11(9)16/h2-7H,1H3.
What are the key properties of 4-chloro-2-(2-chlorophenyl)-7-fluoro-6-methylquinazoline?
4-chloro-2-(2-chlorophenyl)-7-fluoro-6-methylquinazoline has a molecular weight of 307.16 g/mol, XLogP of 5.05, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-2-(2-chlorophenyl)-7-fluoro-6-methylquinazoline is sourced from PubChem (CID 114591625), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).