4-chloro-7-fluoro-6-methyl-2-phenylquinazoline

C15H10ClFN2 — CID 114591614

IUPAC4-chloro-7-fluoro-6-methyl-2-phenylquinazoline
SMILESCc1cc2c(Cl)nc(-c3ccccc3)nc2cc1F
InChIInChI=1S/C15H10ClFN2/c1-9-7-11-13(8-12(9)17)18-15(19-14(11)16)10-5-3-2-4-6-10/h2-8H,1H3
InChIKeyFAWVQDQDSZGYBP-UHFFFAOYSA-N
MW272.71 g/mol
LogP4.40
Rot. Bonds1

About 4-chloro-7-fluoro-6-methyl-2-phenylquinazoline

4-chloro-7-fluoro-6-methyl-2-phenylquinazoline (PubChem CID 114591614) has the molecular formula C15H10ClFN2 and a molecular weight of 272.71 g/mol. Its IUPAC name is 4-chloro-7-fluoro-6-methyl-2-phenylquinazoline.

Molecular Properties

Compound Name4-chloro-7-fluoro-6-methyl-2-phenylquinazoline
PubChem CID114591614
Molecular FormulaC15H10ClFN2
Molecular Weight272.71 g/mol
Exact Mass272.05
IUPAC Name4-chloro-7-fluoro-6-methyl-2-phenylquinazoline
SMILESCc1cc2c(Cl)nc(-c3ccccc3)nc2cc1F
InChIInChI=1S/C15H10ClFN2/c1-9-7-11-13(8-12(9)17)18-15(19-14(11)16)10-5-3-2-4-6-10/h2-8H,1H3
InChIKeyFAWVQDQDSZGYBP-UHFFFAOYSA-N
XLogP4.40
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.71
LogP ≤ 54.40
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

4-chloro-2-(2,6-difluorophenyl)-7-fluoro-6-methylquinazoline
CID 114591658
4-chloro-2-(2-chlorophenyl)-7-fluoro-6-methylquinazoline
CID 114591625
4-chloro-7-fluoro-2-(3-fluoro-5-methylphenyl)-6-methylquinazoline
CID 114591652
6-bromo-4-chloro-7-fluoro-2-(4-methylphenyl)quinazoline
CID 114591279
4-chloro-2-(3-chlorophenyl)-6,7-difluoroquinazoline
CID 114590146
4-chloro-6-fluoro-2-(3-fluoro-4-methylphenyl)quinazoline
CID 63084490
4-chloro-6,7-dimethyl-2-pyridin-4-ylquinazoline
CID 165083752
4,7-dichloro-2-(4-phenylphenyl)quinazoline
CID 87604357
4-chloro-2-phenyl-6-propan-2-ylquinazoline
CID 114590616
4-chloro-6-fluoro-2-(3-methylphenyl)quinazoline
CID 63084323
6-bromo-4-chloro-7-fluoro-2-(3-methoxyphenyl)quinazoline
CID 114591292
2,4-dichloro-6-fluoro-7-methylquinazoline
CID 167510683

Frequently Asked Questions

What is the IUPAC name of 4-chloro-7-fluoro-6-methyl-2-phenylquinazoline?
The IUPAC name of 4-chloro-7-fluoro-6-methyl-2-phenylquinazoline (CID 114591614) is 4-chloro-7-fluoro-6-methyl-2-phenylquinazoline.
What is the SMILES notation for 4-chloro-7-fluoro-6-methyl-2-phenylquinazoline?
The canonical SMILES for 4-chloro-7-fluoro-6-methyl-2-phenylquinazoline is Cc1cc2c(Cl)nc(-c3ccccc3)nc2cc1F.
What is the InChIKey of 4-chloro-7-fluoro-6-methyl-2-phenylquinazoline?
The InChIKey is FAWVQDQDSZGYBP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H10ClFN2/c1-9-7-11-13(8-12(9)17)18-15(19-14(11)16)10-5-3-2-4-6-10/h2-8H,1H3.
What are the key properties of 4-chloro-7-fluoro-6-methyl-2-phenylquinazoline?
4-chloro-7-fluoro-6-methyl-2-phenylquinazoline has a molecular weight of 272.71 g/mol, XLogP of 4.40, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-7-fluoro-6-methyl-2-phenylquinazoline is sourced from PubChem (CID 114591614), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).