n-({3-[(3-{[(5-Chloro-2-thienyl)sulfonyl]amino}-4-hydroxy-1h-indazol-1-yl)methyl]phenyl}methyl)-3-morpholinecarboxamide formate salt

HCID 136346359

Basic information

Standard SMILES
O=C(NCc1cccc(Cn2nc(NS(=O)(=O)c3ccc(Cl)s3)c3c(O)cccc32)c1)C1COCCN1.O=CO
InChIKey
VOMNVECKPIKEGA-UHFFFAOYSA-N
Molecular formula
C25H26ClN5O7S2
Average molar mass
608.1 g/mol

Names & identifiers

Preferred name
n-({3-[(3-{[(5-Chloro-2-thienyl)sulfonyl]amino}-4-hydroxy-1h-indazol-1-yl)methyl]phenyl}methyl)-3-morpholinecarboxamide formate salt
IUPAC
N-[[3-[[3-[(5-chlorothiophen-2-yl)sulfonylamino]-4-hydroxyindazol-1-yl]methyl]phenyl]methyl]morpholine-3-carboxamide;formic acid

Names & synonyms

SCHEMBL356073VOMNVECKPIKEGA-UHFFFAOYSA-Nn-({3-[(3-{[(5-chloro-2-thienyl)sulfonyl]amino}-4-hydroxy-1h-indazol-1-yl)methyl]phenyl}methyl)-3-morpholinecarboxamide formate salt

Database identifiers

PubChem CID
136346359

Properties

Computed structural properties

Topological polar surface area
209 Ų
Hydrogen bond donors
5
Hydrogen bond acceptors
11
Rotatable bonds
8
Heavy atoms
40

Related reactions

3 records

Compound notes

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