N-(4-nitrophenyl)-N'-[quinolin-6-yl]urea

HCID 69522714
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Basic information

Standard SMILES
O=C(Nc1ccc([N+](=O)[O-])cc1)Nc1ccc2ncccc2c1
InChIKey
HZXYPJNAWHVIIX-UHFFFAOYSA-N
Molecular formula
C16H12N4O3
Average molar mass
308.29 g/mol
Monoisotopic mass
308.09094026

Names & identifiers

Preferred name
N-(4-nitrophenyl)-N'-[quinolin-6-yl]urea
IUPAC
1-(4-nitrophenyl)-3-quinolin-6-ylurea

Names & synonyms

SCHEMBL5657895HZXYPJNAWHVIIX-UHFFFAOYSA-NN-(4-nitrophenyl)-N'-[quinolin-6-yl]ureaZ642325318

Database identifiers

PubChem CID
69522714

Properties

Computed structural properties

XLogP
2.8
Topological polar surface area
99.8 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
4
Rotatable bonds
2
Heavy atoms
23

Related reactions

2 records
New reaction record

Linked notes

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