N-(4-[{3-(Dimethylamino)pyrrolidin-1-yl]carbonyl}phenyl)-2,1,3-benzothiadiazol-4-amine

HCID 24794880
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Basic information

Standard SMILES
CN(C)C1CCN(C(=O)c2ccc(Nc3cccc4nsnc34)cc2)C1
InChIKey
JSNWCXLSYPAWMD-UHFFFAOYSA-N
Molecular formula
C19H21N5OS
Average molar mass
367.5 g/mol
Monoisotopic mass
367.14668148

Names & identifiers

Preferred name
N-(4-[{3-(Dimethylamino)pyrrolidin-1-yl]carbonyl}phenyl)-2,1,3-benzothiadiazol-4-amine
IUPAC
[4-(2,1,3-benzothiadiazol-4-ylamino)phenyl]-[3-(dimethylamino)pyrrolidin-1-yl]methanone

Names & synonyms

SCHEMBL2887113JSNWCXLSYPAWMD-UHFFFAOYSA-NN-(4-[{3-(Dimethylamino)pyrrolidin-1-yl]carbonyl}phenyl)-2,1,3-benzothiadiazol-4-amine

Database identifiers

PubChem CID
24794880

Properties

Computed structural properties

XLogP
3
Topological polar surface area
89.6 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
6
Rotatable bonds
4
Heavy atoms
26

Related reactions

2 records
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Compound notes

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