2-chloro-4-(4-methylphenyl)quinazoline

C15H11ClN2 — CID 3122268

IUPAC2-chloro-4-(4-methylphenyl)quinazoline
SMILESCc1ccc(-c2nc(Cl)nc3ccccc23)cc1
InChIInChI=1S/C15H11ClN2/c1-10-6-8-11(9-7-10)14-12-4-2-3-5-13(12)17-15(16)18-14/h2-9H,1H3
InChIKeyXKBDPCKDSHRUDX-UHFFFAOYSA-N
MW254.72 g/mol
LogP4.26
Rot. Bonds1

About 2-chloro-4-(4-methylphenyl)quinazoline

2-chloro-4-(4-methylphenyl)quinazoline (PubChem CID 3122268) has the molecular formula C15H11ClN2 and a molecular weight of 254.72 g/mol. Its IUPAC name is 2-chloro-4-(4-methylphenyl)quinazoline.

Molecular Properties

Compound Name2-chloro-4-(4-methylphenyl)quinazoline
PubChem CID3122268
Molecular FormulaC15H11ClN2
Molecular Weight254.72 g/mol
Exact Mass254.06
IUPAC Name2-chloro-4-(4-methylphenyl)quinazoline
SMILESCc1ccc(-c2nc(Cl)nc3ccccc23)cc1
InChIInChI=1S/C15H11ClN2/c1-10-6-8-11(9-7-10)14-12-4-2-3-5-13(12)17-15(16)18-14/h2-9H,1H3
InChIKeyXKBDPCKDSHRUDX-UHFFFAOYSA-N
XLogP4.26
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.72
LogP ≤ 54.26
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

6-(4-methylphenyl)phenanthridine
CID 10707098
2-chloro-4-(4-phenanthren-9-ylphenyl)quinazoline
CID 142505066
2-chloro-4-(2,4-dimethylphenyl)quinazoline
CID 170033242
2-chloro-4-[4-[4-(2,3,4,5,6-pentadeuteriophenyl)phenyl]phenyl]quinazoline
CID 118545869
2-chloro-4-(6-methoxy-3-pyridinyl)quinazoline
CID 134202247
2-[4-chloro-2-(4-methylphenyl)phenyl]-4-(4-methylphenyl)quinazoline
CID 132599151
4-(4-methylphenyl)-2-(4-methylpiperazin-1-yl)quinazoline
CID 11267128
7-methyl-6-(4-methylphenyl)phenanthridine
CID 135007702
2-chloroquinazolin-4-olate
CID 51422885
4-[4-(4-chloro-6-phenyl-1,3,5-triazin-2-yl)phenyl]quinazoline
CID 164799829
3-(4-methylphenyl)-2-phenylphenanthro[9,10-b]pyrazine
CID 59090361
2-chloro-4-[4-[3-[(3Z,5Z)-octa-3,5,7-trien-2-yl]phenyl]phenyl]quinazoline
CID 144681337

Frequently Asked Questions

What is the IUPAC name of 2-chloro-4-(4-methylphenyl)quinazoline?
The IUPAC name of 2-chloro-4-(4-methylphenyl)quinazoline (CID 3122268) is 2-chloro-4-(4-methylphenyl)quinazoline.
What is the SMILES notation for 2-chloro-4-(4-methylphenyl)quinazoline?
The canonical SMILES for 2-chloro-4-(4-methylphenyl)quinazoline is Cc1ccc(-c2nc(Cl)nc3ccccc23)cc1.
What is the InChIKey of 2-chloro-4-(4-methylphenyl)quinazoline?
The InChIKey is XKBDPCKDSHRUDX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H11ClN2/c1-10-6-8-11(9-7-10)14-12-4-2-3-5-13(12)17-15(16)18-14/h2-9H,1H3.
What are the key properties of 2-chloro-4-(4-methylphenyl)quinazoline?
2-chloro-4-(4-methylphenyl)quinazoline has a molecular weight of 254.72 g/mol, XLogP of 4.26, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-4-(4-methylphenyl)quinazoline is sourced from PubChem (CID 3122268), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).