N-[4-(4-{2-[Methyl-(1-methyl-1H-pyrazole-4-sulfonyl)-amino]-ethyl}-3,4,5,6-tetrahydro-2H-[1,2']bipyrazinyl-3'-yl)-benzyl]-acetamide hydrochloride

HCID 67366252
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Basic information

Standard SMILES
CC(=O)NCc1ccc(-c2nccnc2N2CCN(CCN(C)S(=O)(=O)c3cnn(C)c3)CC2)cc1.Cl
InChIKey
SMPDWLWRQQFOMI-UHFFFAOYSA-N
Molecular formula
C24H33ClN8O3S
Average molar mass
549.1 g/mol

Names & identifiers

Preferred name
N-[4-(4-{2-[Methyl-(1-methyl-1H-pyrazole-4-sulfonyl)-amino]-ethyl}-3,4,5,6-tetrahydro-2H-[1,2']bipyrazinyl-3'-yl)-benzyl]-acetamide hydrochloride
IUPAC
N-[[4-[3-[4-[2-[methyl-(1-methylpyrazol-4-yl)sulfonylamino]ethyl]piperazin-1-yl]pyrazin-2-yl]phenyl]methyl]acetamide;hydrochloride

Names & synonyms

SCHEMBL2330558SMPDWLWRQQFOMI-UHFFFAOYSA-NN-[4-(4-{2-[Methyl-(1-methyl-1H-pyrazole-4-sulfonyl)-amino]-ethyl}-3,4,5,6-tetrahydro-2H-[1,2']bipyrazinyl-3'-yl)-benzyl]-acetamide hydrochloride

Database identifiers

PubChem CID
67366252

Properties

Computed structural properties

Topological polar surface area
125 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
9
Rotatable bonds
9
Heavy atoms
37

Related reactions

1 records
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Compound notes

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