2-(8-methoxy-4-methylquinazolin-6-yl)-5-methyl-1,3-thiazole

C14H13N3OS — CID 155354082

IUPAC2-(8-methoxy-4-methylquinazolin-6-yl)-5-methyl-1,3-thiazole
SMILESCOc1cc(-c2ncc(C)s2)cc2c(C)ncnc12
InChIInChI=1S/C14H13N3OS/c1-8-6-15-14(19-8)10-4-11-9(2)16-7-17-13(11)12(5-10)18-3/h4-7H,1-3H3
InChIKeyAHHFNZOEAROTDA-UHFFFAOYSA-N
MW271.35 g/mol
LogP3.38
Rot. Bonds2

About 2-(8-methoxy-4-methylquinazolin-6-yl)-5-methyl-1,3-thiazole

2-(8-methoxy-4-methylquinazolin-6-yl)-5-methyl-1,3-thiazole (PubChem CID 155354082) has the molecular formula C14H13N3OS and a molecular weight of 271.35 g/mol. Its IUPAC name is 2-(8-methoxy-4-methylquinazolin-6-yl)-5-methyl-1,3-thiazole.

Molecular Properties

Compound Name2-(8-methoxy-4-methylquinazolin-6-yl)-5-methyl-1,3-thiazole
PubChem CID155354082
Molecular FormulaC14H13N3OS
Molecular Weight271.35 g/mol
Exact Mass271.08
IUPAC Name2-(8-methoxy-4-methylquinazolin-6-yl)-5-methyl-1,3-thiazole
SMILESCOc1cc(-c2ncc(C)s2)cc2c(C)ncnc12
InChIInChI=1S/C14H13N3OS/c1-8-6-15-14(19-8)10-4-11-9(2)16-7-17-13(11)12(5-10)18-3/h4-7H,1-3H3
InChIKeyAHHFNZOEAROTDA-UHFFFAOYSA-N
XLogP3.38
TPSA47.90 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.35
LogP ≤ 53.38
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-(8-methoxy-4-methylquinazolin-6-yl)-5-methyl-1,3-thiazole?
The IUPAC name of 2-(8-methoxy-4-methylquinazolin-6-yl)-5-methyl-1,3-thiazole (CID 155354082) is 2-(8-methoxy-4-methylquinazolin-6-yl)-5-methyl-1,3-thiazole.
What is the SMILES notation for 2-(8-methoxy-4-methylquinazolin-6-yl)-5-methyl-1,3-thiazole?
The canonical SMILES for 2-(8-methoxy-4-methylquinazolin-6-yl)-5-methyl-1,3-thiazole is COc1cc(-c2ncc(C)s2)cc2c(C)ncnc12.
What is the InChIKey of 2-(8-methoxy-4-methylquinazolin-6-yl)-5-methyl-1,3-thiazole?
The InChIKey is AHHFNZOEAROTDA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13N3OS/c1-8-6-15-14(19-8)10-4-11-9(2)16-7-17-13(11)12(5-10)18-3/h4-7H,1-3H3.
What are the key properties of 2-(8-methoxy-4-methylquinazolin-6-yl)-5-methyl-1,3-thiazole?
2-(8-methoxy-4-methylquinazolin-6-yl)-5-methyl-1,3-thiazole has a molecular weight of 271.35 g/mol, XLogP of 3.38, 2 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(8-methoxy-4-methylquinazolin-6-yl)-5-methyl-1,3-thiazole is sourced from PubChem (CID 155354082), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).