2,4-dichloro-6-methoxy-7-propoxyquinazoline

C12H12Cl2N2O2 — CID 21330888

IUPAC2,4-dichloro-6-methoxy-7-propoxyquinazoline
SMILESCCCOc1cc2nc(Cl)nc(Cl)c2cc1OC
InChIInChI=1S/C12H12Cl2N2O2/c1-3-4-18-10-6-8-7(5-9(10)17-2)11(13)16-12(14)15-8/h5-6H,3-4H2,1-2H3
InChIKeyXRXQKKAWSWPYET-UHFFFAOYSA-N
MW287.15 g/mol
LogP3.73
Rot. Bonds4

About 2,4-dichloro-6-methoxy-7-propoxyquinazoline

2,4-dichloro-6-methoxy-7-propoxyquinazoline (PubChem CID 21330888) has the molecular formula C12H12Cl2N2O2 and a molecular weight of 287.15 g/mol. Its IUPAC name is 2,4-dichloro-6-methoxy-7-propoxyquinazoline.

Molecular Properties

Compound Name2,4-dichloro-6-methoxy-7-propoxyquinazoline
PubChem CID21330888
Molecular FormulaC12H12Cl2N2O2
Molecular Weight287.15 g/mol
Exact Mass286.03
IUPAC Name2,4-dichloro-6-methoxy-7-propoxyquinazoline
SMILESCCCOc1cc2nc(Cl)nc(Cl)c2cc1OC
InChIInChI=1S/C12H12Cl2N2O2/c1-3-4-18-10-6-8-7(5-9(10)17-2)11(13)16-12(14)15-8/h5-6H,3-4H2,1-2H3
InChIKeyXRXQKKAWSWPYET-UHFFFAOYSA-N
XLogP3.73
TPSA44.24 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.15
LogP ≤ 53.73
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 2,4-dichloro-6-methoxy-7-propoxyquinazoline with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

7-butoxy-4-chloro-2-iodo-6-methoxyquinazoline
CID 130473194
7-bromo-2,4-dichloro-6-methoxyquinazoline
CID 155682427
2-chloro-6-ethoxy-7-methoxy-N-methylquinazolin-4-amine
CID 114693438
N-butyl-2-chloro-6,7-dimethoxyquinazolin-4-amine
CID 22692586
4-chloro-7-methoxy-6-propoxyquinazoline;morpholine;hydrochloride
CID 174738366
4-chloro-7-(3-chloropropoxy)-6-methoxyquinazoline
CID 57447227
CID 90466532
CID 90466532
4-chloro-2-(2-chloroethyl)-6,7-dimethoxyquinazoline
CID 90236933
7-(2-bromoethoxy)-4-chloro-6-methoxyquinazoline
CID 86761073
4-chloro-6,7-dimethoxy-2-methylsulfanylquinazoline
CID 114693063
2,3,6,7,10,11-hexapropoxytriphenylene
CID 15531608
CID 90466535
CID 90466535

Frequently Asked Questions

What is the IUPAC name of 2,4-dichloro-6-methoxy-7-propoxyquinazoline?
The IUPAC name of 2,4-dichloro-6-methoxy-7-propoxyquinazoline (CID 21330888) is 2,4-dichloro-6-methoxy-7-propoxyquinazoline.
What is the SMILES notation for 2,4-dichloro-6-methoxy-7-propoxyquinazoline?
The canonical SMILES for 2,4-dichloro-6-methoxy-7-propoxyquinazoline is CCCOc1cc2nc(Cl)nc(Cl)c2cc1OC.
What is the InChIKey of 2,4-dichloro-6-methoxy-7-propoxyquinazoline?
The InChIKey is XRXQKKAWSWPYET-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H12Cl2N2O2/c1-3-4-18-10-6-8-7(5-9(10)17-2)11(13)16-12(14)15-8/h5-6H,3-4H2,1-2H3.
What are the key properties of 2,4-dichloro-6-methoxy-7-propoxyquinazoline?
2,4-dichloro-6-methoxy-7-propoxyquinazoline has a molecular weight of 287.15 g/mol, XLogP of 3.73, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-dichloro-6-methoxy-7-propoxyquinazoline is sourced from PubChem (CID 21330888), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).