4-(5-Chloro-2,3-methylenedioxypyrid-4-ylamino)-7-(3-chloropropoxy)-6-methoxyquinazoline

HCID 68548521
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Basic information

Standard SMILES
COc1cc2c(Nc3c(Cl)cnc4c3OCO4)ncnc2cc1OCCCCl
InChIKey
LLUKRLDETDNQRG-UHFFFAOYSA-N
Molecular formula
C18H16Cl2N4O4
Average molar mass
423.2 g/mol

Names & identifiers

Preferred name
4-(5-Chloro-2,3-methylenedioxypyrid-4-ylamino)-7-(3-chloropropoxy)-6-methoxyquinazoline
IUPAC
6-chloro-N-[7-(3-chloropropoxy)-6-methoxyquinazolin-4-yl]-[1,3]dioxolo[4,5-b]pyridin-7-amine

Names & synonyms

SCHEMBL3203209LLUKRLDETDNQRG-UHFFFAOYSA-N4-(5-chloro-2,3-methylenedioxypyrid-4-ylamino)-7-(3-chloropropoxy)-6-methoxyquinazoline

Database identifiers

PubChem CID
68548521

Properties

Computed structural properties

XLogP
4
Topological polar surface area
87.6 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
8
Rotatable bonds
7
Heavy atoms
28

Related reactions

4 records
New reaction record

Linked notes

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