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

C20H14N6S — CID 118736906

IUPACN-(4-imidazol-1-ylphenyl)-6-(1,3-thiazol-5-yl)quinazolin-4-amine
SMILESc1cn(-c2ccc(Nc3ncnc4ccc(-c5cncs5)cc34)cc2)cn1
InChIInChI=1S/C20H14N6S/c1-6-18-17(9-14(1)19-10-22-13-27-19)20(24-11-23-18)25-15-2-4-16(5-3-15)26-8-7-21-12-26/h1-13H,(H,23,24,25)
InChIKeyJQZFVAWTPLKKSF-UHFFFAOYSA-N
MW370.44 g/mol
LogP4.68
Rot. Bonds4

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

N-(4-imidazol-1-ylphenyl)-6-(1,3-thiazol-5-yl)quinazolin-4-amine (PubChem CID 118736906) has the molecular formula C20H14N6S and a molecular weight of 370.44 g/mol. Its IUPAC name is N-(4-imidazol-1-ylphenyl)-6-(1,3-thiazol-5-yl)quinazolin-4-amine.

Molecular Properties

Compound NameN-(4-imidazol-1-ylphenyl)-6-(1,3-thiazol-5-yl)quinazolin-4-amine
PubChem CID118736906
Molecular FormulaC20H14N6S
Molecular Weight370.44 g/mol
Exact Mass370.10
IUPAC NameN-(4-imidazol-1-ylphenyl)-6-(1,3-thiazol-5-yl)quinazolin-4-amine
SMILESc1cn(-c2ccc(Nc3ncnc4ccc(-c5cncs5)cc34)cc2)cn1
InChIInChI=1S/C20H14N6S/c1-6-18-17(9-14(1)19-10-22-13-27-19)20(24-11-23-18)25-15-2-4-16(5-3-15)26-8-7-21-12-26/h1-13H,(H,23,24,25)
InChIKeyJQZFVAWTPLKKSF-UHFFFAOYSA-N
XLogP4.68
TPSA68.52 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500370.44
LogP ≤ 54.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Related Compounds

7-[5,6-Dimethyl-2-(1,3-Thiazol-2-Yl)-1h-Benzimidazol-1-Yl]quinazoline-2,4-Diamine
CID 46871716
Timegadine
CID 68902
7-[5,6-Dimethyl-2-(1,3-Thiazol-4-Yl)-1h-Benzimidazol-1-Yl]quinazoline-2,4-Diamine
CID 72771095
7-[5,6-Dimethyl-2-(1,3-thiazol-2-yl)benzimidazol-1-yl]-6-methylquinazoline-2,4-diamine
CID 67889364
[4-(2-Methyl-imidazo[1,2-a]pyrimidin-3-yl)-thiazol-2-yl]-p-tolyl-amine
CID 2898055
8-[2-(5-Methyl-1H-imidazol-4-ylmethyl)-thiazol-4-yl]-quinoline
CID 14722779
2-(1H-imidazol-5-ylmethyl)-4-quinolin-8-yl-1,3-thiazole
CID 14742548
4-[2-(6-Phenylimidazo[2,1-b][1,3]thiazol-5-yl)vinyl]-2-pyrimidinamine
CID 5916724
(2-Imidazol-1-yl-quinazolin-4-yl)-thiophen-2-ylmethyl-amine
CID 9995367
5-methyl-N-(2-phenylquinazolin-4-yl)thiazol-2-amine
CID 10236668
2-(4-methylthiazol-2-yl)-N-(pyridin-4-yl)quinazolin-4-amine
CID 10358578
1-N,1-N-diethyl-4-methyl-3-N-[4-[4-(4-methylimidazol-1-yl)phenyl]-1,3-thiazol-2-yl]benzene-1,3-diamine
CID 58910631

Frequently Asked Questions

What is the IUPAC name of N-(4-imidazol-1-ylphenyl)-6-(1,3-thiazol-5-yl)quinazolin-4-amine?
The IUPAC name of N-(4-imidazol-1-ylphenyl)-6-(1,3-thiazol-5-yl)quinazolin-4-amine (CID 118736906) is N-(4-imidazol-1-ylphenyl)-6-(1,3-thiazol-5-yl)quinazolin-4-amine.
What is the SMILES notation for N-(4-imidazol-1-ylphenyl)-6-(1,3-thiazol-5-yl)quinazolin-4-amine?
The canonical SMILES for N-(4-imidazol-1-ylphenyl)-6-(1,3-thiazol-5-yl)quinazolin-4-amine is c1cn(-c2ccc(Nc3ncnc4ccc(-c5cncs5)cc34)cc2)cn1.
What is the InChIKey of N-(4-imidazol-1-ylphenyl)-6-(1,3-thiazol-5-yl)quinazolin-4-amine?
The InChIKey is JQZFVAWTPLKKSF-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H14N6S/c1-6-18-17(9-14(1)19-10-22-13-27-19)20(24-11-23-18)25-15-2-4-16(5-3-15)26-8-7-21-12-26/h1-13H,(H,23,24,25).
What are the key properties of N-(4-imidazol-1-ylphenyl)-6-(1,3-thiazol-5-yl)quinazolin-4-amine?
N-(4-imidazol-1-ylphenyl)-6-(1,3-thiazol-5-yl)quinazolin-4-amine has a molecular weight of 370.44 g/mol, XLogP of 4.68, 4 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-imidazol-1-ylphenyl)-6-(1,3-thiazol-5-yl)quinazolin-4-amine is sourced from PubChem (CID 118736906), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).