ethyl {4-[(2-{7-[(2-thienylsulfonyl)amino]-1H-indol-2-yl}-1,3-thiazol-5-yl)methyl]piperazin-1-yl}acetate
Basic information
- Standard SMILES
CCOC(=O)CN1CCN(Cc2cnc(-c3cc4cccc(NS(=O)(=O)c5cccs5)c4[nH]3)s2)CC1- InChIKey
FMIXBJABLDZKCB-UHFFFAOYSA-N- Molecular formula
- C24H27N5O4S3
- Average molar mass
- 545.7 g/mol
Names & identifiers
- Preferred name
- ethyl {4-[(2-{7-[(2-thienylsulfonyl)amino]-1H-indol-2-yl}-1,3-thiazol-5-yl)methyl]piperazin-1-yl}acetate
- IUPAC
- ethyl 2-[4-[[2-[7-(thiophen-2-ylsulfonylamino)-1H-indol-2-yl]-1,3-thiazol-5-yl]methyl]piperazin-1-yl]acetate
Names & synonyms
SCHEMBL13312875FMIXBJABLDZKCB-UHFFFAOYSA-Nethyl {4-[(2-{7-[(2-thienylsulfonyl)amino]-1H-indol-2-yl}-1,3-thiazol-5-yl)methyl]piperazin-1-yl}acetateethyl{4-[(2-{7-[(2-thienylsulfonyl)amino]-1H-indol-2-yl}-1,3-thiazol-5-yl)methyl]piperazin-1-yl}acetate
Database identifiers
- PubChem CID
- 59136017
Properties
Computed structural properties
- XLogP
- 3.3
- Topological polar surface area
- 172 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 10
- Rotatable bonds
- 10
- Heavy atoms
- 36
- Formal charge
- 0
- Complexity
- 851
Related reactions
8 records
Compound notes
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