N-(4-methylphenyl)-6-(1,3-thiazol-5-yl)quinazolin-4-amine

C18H14N4S — CID 118736897

IUPACN-(4-methylphenyl)-6-(1,3-thiazol-5-yl)quinazolin-4-amine
SMILESCc1ccc(Nc2ncnc3ccc(-c4cncs4)cc23)cc1
InChIInChI=1S/C18H14N4S/c1-12-2-5-14(6-3-12)22-18-15-8-13(17-9-19-11-23-17)4-7-16(15)20-10-21-18/h2-11H,1H3,(H,20,21,22)
InChIKeyMOKKZCCTNRQAHN-UHFFFAOYSA-N
MW318.41 g/mol
LogP4.81
Rot. Bonds3

About N-(4-methylphenyl)-6-(1,3-thiazol-5-yl)quinazolin-4-amine

N-(4-methylphenyl)-6-(1,3-thiazol-5-yl)quinazolin-4-amine (PubChem CID 118736897) has the molecular formula C18H14N4S and a molecular weight of 318.41 g/mol. Its IUPAC name is N-(4-methylphenyl)-6-(1,3-thiazol-5-yl)quinazolin-4-amine.

Molecular Properties

Compound NameN-(4-methylphenyl)-6-(1,3-thiazol-5-yl)quinazolin-4-amine
PubChem CID118736897
Molecular FormulaC18H14N4S
Molecular Weight318.41 g/mol
Exact Mass318.09
IUPAC NameN-(4-methylphenyl)-6-(1,3-thiazol-5-yl)quinazolin-4-amine
SMILESCc1ccc(Nc2ncnc3ccc(-c4cncs4)cc23)cc1
InChIInChI=1S/C18H14N4S/c1-12-2-5-14(6-3-12)22-18-15-8-13(17-9-19-11-23-17)4-7-16(15)20-10-21-18/h2-11H,1H3,(H,20,21,22)
InChIKeyMOKKZCCTNRQAHN-UHFFFAOYSA-N
XLogP4.81
TPSA50.70 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500318.41
LogP ≤ 54.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-pyridin-3-yl-6-(1,3-thiazol-5-yl)quinazolin-4-amine
CID 118736909
N-(3-chlorophenyl)-6-(1,3-thiazol-5-yl)quinazolin-4-amine
CID 118736892
6-methyl-N-(4-methylphenyl)quinazolin-4-amine
CID 5328827
N-(2-fluorophenyl)-6-(1,3-thiazol-5-yl)quinazolin-4-amine
CID 118736896
N-(oxan-4-yl)-6-(1,3-thiazol-5-yl)quinazolin-4-amine
CID 118736916
6-(4-methylthiophen-2-yl)-N-(4-morpholin-4-ylphenyl)quinazolin-4-amine
CID 15956172
N-(4-methylphenyl)-6-nitroquinazolin-4-amine
CID 127027330
N,6-diphenylquinazolin-4-amine
CID 86766666
N-[6-(4-methyl-1,3-thiazol-2-yl)quinazolin-4-yl]-1,3-benzothiazol-5-amine
CID 177371837
4-N-(4-iodophenyl)quinazoline-4,6-diamine
CID 64588865
(4-ethoxyphenyl)-[4-[(6-methylquinazolin-4-yl)amino]phenyl]methanone
CID 142858154
6-(3,5-dimethyl-1,2-oxazol-4-yl)-N-phenylquinazolin-4-amine
CID 3234707

Frequently Asked Questions

What is the IUPAC name of N-(4-methylphenyl)-6-(1,3-thiazol-5-yl)quinazolin-4-amine?
The IUPAC name of N-(4-methylphenyl)-6-(1,3-thiazol-5-yl)quinazolin-4-amine (CID 118736897) is N-(4-methylphenyl)-6-(1,3-thiazol-5-yl)quinazolin-4-amine.
What is the SMILES notation for N-(4-methylphenyl)-6-(1,3-thiazol-5-yl)quinazolin-4-amine?
The canonical SMILES for N-(4-methylphenyl)-6-(1,3-thiazol-5-yl)quinazolin-4-amine is Cc1ccc(Nc2ncnc3ccc(-c4cncs4)cc23)cc1.
What is the InChIKey of N-(4-methylphenyl)-6-(1,3-thiazol-5-yl)quinazolin-4-amine?
The InChIKey is MOKKZCCTNRQAHN-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H14N4S/c1-12-2-5-14(6-3-12)22-18-15-8-13(17-9-19-11-23-17)4-7-16(15)20-10-21-18/h2-11H,1H3,(H,20,21,22).
What are the key properties of N-(4-methylphenyl)-6-(1,3-thiazol-5-yl)quinazolin-4-amine?
N-(4-methylphenyl)-6-(1,3-thiazol-5-yl)quinazolin-4-amine has a molecular weight of 318.41 g/mol, XLogP of 4.81, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-methylphenyl)-6-(1,3-thiazol-5-yl)quinazolin-4-amine is sourced from PubChem (CID 118736897), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).