4-[(3,4-Dichloro-6-fluorophenyl)amino]-6-nitroquinazoline

HCID 15480998
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Basic information

Standard SMILES
O=[N+]([O-])c1ccc2ncnc(Nc3cc(Cl)c(Cl)cc3F)c2c1
InChIKey
HWDOAVZUJXVQFG-UHFFFAOYSA-N
Molecular formula
C14H7Cl2FN4O2
Average molar mass
353.1 g/mol

Names & identifiers

Preferred name
4-[(3,4-Dichloro-6-fluorophenyl)amino]-6-nitroquinazoline
IUPAC
N-(4,5-dichloro-2-fluorophenyl)-6-nitroquinazolin-4-amine

Names & synonyms

SCHEMBL3243771HWDOAVZUJXVQFG-UHFFFAOYSA-N4-[(3,4-dichloro-6-fluorophenyl)amino]-6-nitroquinazoline6-nitro-4-[(3,4-dichloro-6-fluorophenyl)amino]-quinazoline

Database identifiers

PubChem CID
15480998

Properties

Computed structural properties

XLogP
4.6
Topological polar surface area
83.6 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
6
Rotatable bonds
2
Heavy atoms
23

Related reactions

12 records
New reaction record

Linked notes

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