4,8-dichloro-2-(4-methoxythiophen-2-yl)-6-methylquinazoline

C14H10Cl2N2OS — CID 114590837

IUPAC4,8-dichloro-2-(4-methoxythiophen-2-yl)-6-methylquinazoline
SMILESCOc1csc(-c2nc(Cl)c3cc(C)cc(Cl)c3n2)c1
InChIInChI=1S/C14H10Cl2N2OS/c1-7-3-9-12(10(15)4-7)17-14(18-13(9)16)11-5-8(19-2)6-20-11/h3-6H,1-2H3
InChIKeyBQZFQJIEXMIMKU-UHFFFAOYSA-N
MW325.22 g/mol
LogP4.98
Rot. Bonds2

About 4,8-dichloro-2-(4-methoxythiophen-2-yl)-6-methylquinazoline

4,8-dichloro-2-(4-methoxythiophen-2-yl)-6-methylquinazoline (PubChem CID 114590837) has the molecular formula C14H10Cl2N2OS and a molecular weight of 325.22 g/mol. Its IUPAC name is 4,8-dichloro-2-(4-methoxythiophen-2-yl)-6-methylquinazoline.

Molecular Properties

Compound Name4,8-dichloro-2-(4-methoxythiophen-2-yl)-6-methylquinazoline
PubChem CID114590837
Molecular FormulaC14H10Cl2N2OS
Molecular Weight325.22 g/mol
Exact Mass323.99
IUPAC Name4,8-dichloro-2-(4-methoxythiophen-2-yl)-6-methylquinazoline
SMILESCOc1csc(-c2nc(Cl)c3cc(C)cc(Cl)c3n2)c1
InChIInChI=1S/C14H10Cl2N2OS/c1-7-3-9-12(10(15)4-7)17-14(18-13(9)16)11-5-8(19-2)6-20-11/h3-6H,1-2H3
InChIKeyBQZFQJIEXMIMKU-UHFFFAOYSA-N
XLogP4.98
TPSA35.01 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.22
LogP ≤ 54.98
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

4,8-dichloro-6-methyl-2-thieno[3,2-b]thiophen-5-ylquinazoline
CID 114590852
4-chloro-2-(4-methoxythiophen-2-yl)-7-nitroquinazoline
CID 114589444
2-(4-methoxythiophen-2-yl)-N,8-dimethylquinazolin-4-amine
CID 81129462
4,8-dichloro-2-(3-chloro-4-methylphenyl)-6-methylquinazoline
CID 114590874
4,8-dichloro-2-(3-fluorophenyl)-6-methylquinazoline
CID 114590868
4,8-dichloro-2-(2,3-difluorophenyl)-6-methylquinazoline
CID 114590823
4,8-dichloro-6-methyl-2-(2-methylsulfanylphenyl)quinazoline
CID 114590827
4,6,8-trichloro-2-(3-chloro-4-methylthiophen-2-yl)quinazoline
CID 103400530
6-bromo-4-chloro-2-(4-methoxyphenyl)-8-methylquinazoline
CID 114591070
5-(4,6,8-trichloroquinazolin-2-yl)-1,3-thiazole
CID 114031049
6-chloro-N-ethyl-2-(4-methoxythiophen-2-yl)quinazolin-4-amine
CID 81128551
4-chloro-2-(3-ethylthiophen-2-yl)-6-methoxy-8-methylquinazoline
CID 114591522

Frequently Asked Questions

What is the IUPAC name of 4,8-dichloro-2-(4-methoxythiophen-2-yl)-6-methylquinazoline?
The IUPAC name of 4,8-dichloro-2-(4-methoxythiophen-2-yl)-6-methylquinazoline (CID 114590837) is 4,8-dichloro-2-(4-methoxythiophen-2-yl)-6-methylquinazoline.
What is the SMILES notation for 4,8-dichloro-2-(4-methoxythiophen-2-yl)-6-methylquinazoline?
The canonical SMILES for 4,8-dichloro-2-(4-methoxythiophen-2-yl)-6-methylquinazoline is COc1csc(-c2nc(Cl)c3cc(C)cc(Cl)c3n2)c1.
What is the InChIKey of 4,8-dichloro-2-(4-methoxythiophen-2-yl)-6-methylquinazoline?
The InChIKey is BQZFQJIEXMIMKU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10Cl2N2OS/c1-7-3-9-12(10(15)4-7)17-14(18-13(9)16)11-5-8(19-2)6-20-11/h3-6H,1-2H3.
What are the key properties of 4,8-dichloro-2-(4-methoxythiophen-2-yl)-6-methylquinazoline?
4,8-dichloro-2-(4-methoxythiophen-2-yl)-6-methylquinazoline has a molecular weight of 325.22 g/mol, XLogP of 4.98, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4,8-dichloro-2-(4-methoxythiophen-2-yl)-6-methylquinazoline is sourced from PubChem (CID 114590837), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).