4-{N'-[2-(4-Nitro-phenyl)-4H-furo[3,2-b]pyrrole-5-carbonyl]-hydrazino}-butyric acid ethyl ester

HCID 59463453
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Basic information

Standard SMILES
CCOC(=O)CCCNNC(=O)c1cc2oc(-c3ccc([N+](=O)[O-])cc3)cc2[nH]1
InChIKey
NGKKKRUYYXFNCH-UHFFFAOYSA-N
Molecular formula
C19H20N4O6
Average molar mass
400.4 g/mol
Monoisotopic mass
400.13828437

Names & identifiers

Preferred name
4-{N'-[2-(4-Nitro-phenyl)-4H-furo[3,2-b]pyrrole-5-carbonyl]-hydrazino}-butyric acid ethyl ester
IUPAC
ethyl 4-[2-[2-(4-nitrophenyl)-4H-furo[3,2-b]pyrrole-5-carbonyl]hydrazinyl]butanoate

Names & synonyms

SCHEMBL3072980NGKKKRUYYXFNCH-UHFFFAOYSA-N4-{N'-[2-(4-Nitro-phenyl)-4H-furo[3,2-b]pyrrole-5-carbonyl]-hydrazino}-butyric acid ethyl ester

Database identifiers

PubChem CID
59463453

Properties

Computed structural properties

XLogP
2.6
Topological polar surface area
142 Ų
Hydrogen bond donors
3
Hydrogen bond acceptors
7
Rotatable bonds
9
Heavy atoms
29

Related reactions

1 records
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Linked notes

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