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Basic information
- Standard SMILES
COCCOc1cc(N(CC2CC2)S(=O)(=O)c2ccccn2)c2[nH]c(C3=NCC(CN4CCS(=O)CC4)S3)cc2c1- InChIKey
DMGDCGPDQZDSGP-UHFFFAOYSA-N- Molecular formula
- C28H35N5O5S3
- Average molar mass
- 617.8 g/mol
- Monoisotopic mass
- 617.18003275
Names & identifiers
- Preferred name
- N-(cyclopropylmethyl)-N-(5-(2-methoxyethoxy)-2-{5-[(1-oxidothiomorpholino)methyl]-4,5-dihydro-1,3-thiazol-2-yl}-1H-indol-7-yl)pyridine-2-sulfonamide
- IUPAC
- N-(cyclopropylmethyl)-N-[5-(2-methoxyethoxy)-2-[5-[(1-oxo-1,4-thiazinan-4-yl)methyl]-4,5-dihydro-1,3-thiazol-2-yl]-1H-indol-7-yl]pyridine-2-sulfonamide
Names & synonyms
SCHEMBL2978331DMGDCGPDQZDSGP-UHFFFAOYSA-NN-(cyclopropylmethyl)-N-(5-(2-methoxyethoxy)-2-{5-[(1-oxidothiomorpholino)methyl]-4,5-dihydro-1,3-thiazol-2-yl}-1H-indol-7-yl)pyridine-2-sulfonamide
Database identifiers
- PubChem CID
- 59136142
Properties
Computed structural propertiesFilling in
- XLogP
- 1.9
- Topological polar surface area
- 170 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 11
- Rotatable bonds
- 12
- Heavy atoms
- 41
- Formal charge
- 0
- Complexity
- 1,040
Related reactions
4 records
Compound notes
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