Basic information
- Standard SMILES
COC[C@H](C)Oc1cc(N(C)S(=O)(=O)c2ccccn2)c2[nH]c(C3=NCC(CN4CCSCC4)S3)cc2c1- InChIKey
HVHXPIIBJPQFQF-YMXDCFFPSA-N- Molecular formula
- C26H33N5O4S3
- Average molar mass
- 575.8 g/mol
- Monoisotopic mass
- 575.16946807
Names & identifiers
- Preferred name
- N-{5-[(1S)-2-methoxy-1-methylethoxy]-2-[5-(thiomorpholinomethyl)-4,5-dihydro-1,3-thiazol-2-yl]-1H-indol-7-yl}-N-methylpyridine-2-sulfonamide
- IUPAC
- N-[5-[(2S)-1-methoxypropan-2-yl]oxy-2-[5-(thiomorpholin-4-ylmethyl)-4,5-dihydro-1,3-thiazol-2-yl]-1H-indol-7-yl]-N-methylpyridine-2-sulfonamide
Names & synonyms
SCHEMBL2976990HVHXPIIBJPQFQF-YMXDCFFPSA-NN-{5-[(1S)-2-methoxy-1-methylethoxy]-2-[5-(thiomorpholinomethyl)-4,5-dihydro-1,3-thiazol-2-yl]-1H-indol-7-yl}-N-methylpyridine-2-sulfonamide
Database identifiers
- PubChem CID
- 59136134
Properties
Computed structural properties
- XLogP
- 3.2
- Topological polar surface area
- 159 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 10
- Rotatable bonds
- 10
- Heavy atoms
- 38
- Formal charge
- 0
- Complexity
- 913
Related reactions
8 records
Compound notes
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