N,N-dimethyl-2-{4-[(2-{7-[(2-thienylsulfonyl)amino]-1H-indol-2-yl}-1,3-thiazol-5-yl)methyl]piperazin-1-yl}acetamide

HCID 59136046

Basic information

Standard SMILES
CN(C)C(=O)CN1CCN(Cc2cnc(-c3cc4cccc(NS(=O)(=O)c5cccs5)c4[nH]3)s2)CC1
InChIKey
OPBASMGXKWMJTC-UHFFFAOYSA-N
Molecular formula
C24H28N6O3S3
Average molar mass
544.7 g/mol
Monoisotopic mass
544.1385023

Names & identifiers

Preferred name
N,N-dimethyl-2-{4-[(2-{7-[(2-thienylsulfonyl)amino]-1H-indol-2-yl}-1,3-thiazol-5-yl)methyl]piperazin-1-yl}acetamide
IUPAC
N,N-dimethyl-2-[4-[[2-[7-(thiophen-2-ylsulfonylamino)-1H-indol-2-yl]-1,3-thiazol-5-yl]methyl]piperazin-1-yl]acetamide

Names & synonyms

SCHEMBL2971705OPBASMGXKWMJTC-UHFFFAOYSA-NN,N-dimethyl-2-{4-[(2-{7-[(2-thienylsulfonyl)amino]-1H-indol-2-yl}-1,3-thiazol-5-yl)methyl]piperazin-1-yl}acetamide

Database identifiers

PubChem CID
59136046

Properties

Computed structural properties

XLogP
2.5
Topological polar surface area
167 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
9
Rotatable bonds
8
Heavy atoms
36

Related reactions

5 records

Linked notes

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