Basic information
- Standard SMILES
CCN(c1cc2nn(-c3ccc(OCc4ccccc4)nc3)c(C(=O)NC)c2cc1C1CC1)S(C)(=O)=O- InChIKey
XROHNDZNUMTVLW-UHFFFAOYSA-N- Molecular formula
- C27H29N5O4S
- Average molar mass
- 519.6 g/mol
- Monoisotopic mass
- 519.1940256
Names & identifiers
- Preferred name
- 2-(6-benzyloxy-3-pyridyl)-5-cyclopropyl-6-[ethyl(methylsulfonyl)amino]-N-methyl-indazole-3-carboxamide
- IUPAC
- 5-cyclopropyl-6-[ethyl(methylsulfonyl)amino]-N-methyl-2-(6-phenylmethoxy-3-pyridinyl)indazole-3-carboxamide
Names & synonyms
SCHEMBL9106987XROHNDZNUMTVLW-UHFFFAOYSA-N2-(6-benzyloxy-3-pyridyl)-5-cyclopropyl-6-[ethyl(methylsulfonyl)amino]-N-methyl-indazole-3-carboxamide
Database identifiers
- PubChem CID
- 67775366
Properties
Computed structural properties
- XLogP
- 4
- Topological polar surface area
- 115 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 9
- Heavy atoms
- 37
- Formal charge
- 0
- Complexity
- 888
Related reactions
1 records
Compound notes
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