2-(7-methoxy-8-methyl-4-propan-2-yloxyquinazolin-2-yl)-4-propan-2-yl-1,3-thiazole;2-(7-methoxy-8-methyl-4-propan-2-yloxyquinolin-2-yl)-4-propan-2-yl-1,3-thiazole

C39H47N5O4S2 — CID 158578050

IUPAC2-(7-methoxy-8-methyl-4-propan-2-yloxyquinazolin-2-yl)-4-propan-2-yl-1,3-thiazole;2-(7-methoxy-8-methyl-4-propan-2-yloxyquinolin-2-yl)-4-propan-2-yl-1,3-thiazole
SMILESCOc1ccc2c(OC(C)C)cc(-c3nc(C(C)C)cs3)nc2c1C.COc1ccc2c(OC(C)C)nc(-c3nc(C(C)C)cs3)nc2c1C
InChIInChI=1S/C20H24N2O2S.C19H23N3O2S/c1-11(2)16-10-25-20(22-16)15-9-18(24-12(3)4)14-7-8-17(23-6)13(5)19(14)21-15;1-10(2)14-9-25-19(20-14)17-21-16-12(5)15(23-6)8-7-13(16)18(22-17)24-11(3)4/h7-12H,1-6H3;7-11H,1-6H3
InChIKeyHSXCNQSNVKZKJK-UHFFFAOYSA-N
MW713.97 g/mol
LogP10.57
Rot. Bonds10

About 2-(7-methoxy-8-methyl-4-propan-2-yloxyquinazolin-2-yl)-4-propan-2-yl-1,3-thiazole;2-(7-methoxy-8-methyl-4-propan-2-yloxyquinolin-2-yl)-4-propan-2-yl-1,3-thiazole

2-(7-methoxy-8-methyl-4-propan-2-yloxyquinazolin-2-yl)-4-propan-2-yl-1,3-thiazole;2-(7-methoxy-8-methyl-4-propan-2-yloxyquinolin-2-yl)-4-propan-2-yl-1,3-thiazole (PubChem CID 158578050) has the molecular formula C39H47N5O4S2 and a molecular weight of 713.97 g/mol. Its IUPAC name is 2-(7-methoxy-8-methyl-4-propan-2-yloxyquinazolin-2-yl)-4-propan-2-yl-1,3-thiazole;2-(7-methoxy-8-methyl-4-propan-2-yloxyquinolin-2-yl)-4-propan-2-yl-1,3-thiazole.

Molecular Properties

Compound Name2-(7-methoxy-8-methyl-4-propan-2-yloxyquinazolin-2-yl)-4-propan-2-yl-1,3-thiazole;2-(7-methoxy-8-methyl-4-propan-2-yloxyquinolin-2-yl)-4-propan-2-yl-1,3-thiazole
PubChem CID158578050
Molecular FormulaC39H47N5O4S2
Molecular Weight713.97 g/mol
Exact Mass713.31
IUPAC Name2-(7-methoxy-8-methyl-4-propan-2-yloxyquinazolin-2-yl)-4-propan-2-yl-1,3-thiazole;2-(7-methoxy-8-methyl-4-propan-2-yloxyquinolin-2-yl)-4-propan-2-yl-1,3-thiazole
SMILESCOc1ccc2c(OC(C)C)cc(-c3nc(C(C)C)cs3)nc2c1C.COc1ccc2c(OC(C)C)nc(-c3nc(C(C)C)cs3)nc2c1C
InChIInChI=1S/C20H24N2O2S.C19H23N3O2S/c1-11(2)16-10-25-20(22-16)15-9-18(24-12(3)4)14-7-8-17(23-6)13(5)19(14)21-15;1-10(2)14-9-25-19(20-14)17-21-16-12(5)15(23-6)8-7-13(16)18(22-17)24-11(3)4/h7-12H,1-6H3;7-11H,1-6H3
InChIKeyHSXCNQSNVKZKJK-UHFFFAOYSA-N
XLogP10.57
TPSA101.37 Ų
H-Bond Donors
H-Bond Acceptors11
Rotatable Bonds10
Heavy Atoms50
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 500713.97
LogP ≤ 510.57
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1011

Analyze 2-(7-methoxy-8-methyl-4-propan-2-yloxyquinazolin-2-yl)-4-propan-2-yl-1,3-thiazole;2-(7-methoxy-8-methyl-4-propan-2-yloxyquinolin-2-yl)-4-propan-2-yl-1,3-thiazole with MolForge

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Launch Full Analysis

Related Compounds

5-[6-[(4-Methoxyphenyl)methoxy]-2-[4-(trifluoromethyl)-1,3-thiazol-2-yl]pyrimidin-4-yl]-2,4-dimethyl-1,3-thiazole
CID 58282622
1-O-benzyl 2-O-methyl (2S,4S)-4-[7-methoxy-8-methyl-2-[4-(trifluoromethyl)-1,3-thiazol-2-yl]quinazolin-4-yl]oxypiperidine-1,2-dicarboxylate
CID 59533429
4-Isopropyl-2-(6-(4-methoxybenzyloxy)-2-(4-(trifluoromethyl)thiazol-2-yl)pyrimidin-4-yl)thiazole
CID 68160018
(1S,4R,6S,18S)-18-[7-methoxy-8-methyl-2-[4-(trifluoromethyl)-1,3-thiazol-2-yl]quinazolin-4-yl]oxy-13-methyl-2,14-dioxo-3,13,15-triazatricyclo[13.4.0.04,6]nonadec-7-ene-4-carboxamide
CID 68499079
18-[7-Methoxy-8-methyl-2-[4-(trifluoromethyl)-1,3-thiazol-2-yl]quinazolin-4-yl]oxy-13-methyl-2,14-dioxo-3,13,15-triazatricyclo[13.4.0.04,6]nonadec-7-ene-4-carboxamide
CID 68797777
2-(8-Fluoro-7-methoxy-4-methylquinazolin-2-yl)-4-propan-2-yl-1,3-thiazole
CID 70252260
2-N-[4-[[[2-(2,3-dihydro-1-benzofuran-5-yl)-1,3-thiazol-4-yl]methylamino]methyl]cyclohexyl]-4-N,4-N-dimethylquinazoline-2,4-diamine
CID 57714858
2-(4,7-Dimethoxy-8-methylquinazolin-2-yl)-4-propan-2-yl-1,3-thiazole
CID 57785173
(2S,4R)-4-[7-methoxy-8-methyl-2-(4-propan-2-yl-1,3-thiazol-2-yl)quinazolin-4-yl]oxy-1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidine-2-carboxylic acid
CID 58212836
2-(7-Methoxy-8-methyl-4-propan-2-yloxyquinolin-2-yl)-4-propan-2-yl-1,3-thiazole
CID 58212872
2-(4-Chloro-7-methoxy-8-methylquinazolin-2-yl)-4-propan-2-yl-1,3-thiazole
CID 58212886
2-(7-Methoxy-8-methyl-4-propan-2-yloxyquinazolin-2-yl)-4-propan-2-yl-1,3-thiazole
CID 58213304

Frequently Asked Questions

What is the IUPAC name of 2-(7-methoxy-8-methyl-4-propan-2-yloxyquinazolin-2-yl)-4-propan-2-yl-1,3-thiazole;2-(7-methoxy-8-methyl-4-propan-2-yloxyquinolin-2-yl)-4-propan-2-yl-1,3-thiazole?
The IUPAC name of 2-(7-methoxy-8-methyl-4-propan-2-yloxyquinazolin-2-yl)-4-propan-2-yl-1,3-thiazole;2-(7-methoxy-8-methyl-4-propan-2-yloxyquinolin-2-yl)-4-propan-2-yl-1,3-thiazole (CID 158578050) is 2-(7-methoxy-8-methyl-4-propan-2-yloxyquinazolin-2-yl)-4-propan-2-yl-1,3-thiazole;2-(7-methoxy-8-methyl-4-propan-2-yloxyquinolin-2-yl)-4-propan-2-yl-1,3-thiazole.
What is the SMILES notation for 2-(7-methoxy-8-methyl-4-propan-2-yloxyquinazolin-2-yl)-4-propan-2-yl-1,3-thiazole;2-(7-methoxy-8-methyl-4-propan-2-yloxyquinolin-2-yl)-4-propan-2-yl-1,3-thiazole?
The canonical SMILES for 2-(7-methoxy-8-methyl-4-propan-2-yloxyquinazolin-2-yl)-4-propan-2-yl-1,3-thiazole;2-(7-methoxy-8-methyl-4-propan-2-yloxyquinolin-2-yl)-4-propan-2-yl-1,3-thiazole is COc1ccc2c(OC(C)C)cc(-c3nc(C(C)C)cs3)nc2c1C.COc1ccc2c(OC(C)C)nc(-c3nc(C(C)C)cs3)nc2c1C.
What is the InChIKey of 2-(7-methoxy-8-methyl-4-propan-2-yloxyquinazolin-2-yl)-4-propan-2-yl-1,3-thiazole;2-(7-methoxy-8-methyl-4-propan-2-yloxyquinolin-2-yl)-4-propan-2-yl-1,3-thiazole?
The InChIKey is HSXCNQSNVKZKJK-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24N2O2S.C19H23N3O2S/c1-11(2)16-10-25-20(22-16)15-9-18(24-12(3)4)14-7-8-17(23-6)13(5)19(14)21-15;1-10(2)14-9-25-19(20-14)17-21-16-12(5)15(23-6)8-7-13(16)18(22-17)24-11(3)4/h7-12H,1-6H3;7-11H,1-6H3.
What are the key properties of 2-(7-methoxy-8-methyl-4-propan-2-yloxyquinazolin-2-yl)-4-propan-2-yl-1,3-thiazole;2-(7-methoxy-8-methyl-4-propan-2-yloxyquinolin-2-yl)-4-propan-2-yl-1,3-thiazole?
2-(7-methoxy-8-methyl-4-propan-2-yloxyquinazolin-2-yl)-4-propan-2-yl-1,3-thiazole;2-(7-methoxy-8-methyl-4-propan-2-yloxyquinolin-2-yl)-4-propan-2-yl-1,3-thiazole has a molecular weight of 713.97 g/mol, XLogP of 10.57, 10 rotatable bonds, 0 hydrogen bond donors, and 11 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(7-methoxy-8-methyl-4-propan-2-yloxyquinazolin-2-yl)-4-propan-2-yl-1,3-thiazole;2-(7-methoxy-8-methyl-4-propan-2-yloxyquinolin-2-yl)-4-propan-2-yl-1,3-thiazole is sourced from PubChem (CID 158578050), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).