Basic information
- Standard SMILES
O=C(c1ccc(S(=O)(=O)N2CCOCC2)cc1)N1CCCC1CN1CCCC1- InChIKey
IBHVIFPZHXGGDA-UHFFFAOYSA-N- Molecular formula
- C20H29N3O4S
- Average molar mass
- 407.5 g/mol
Names & identifiers
- Preferred name
- (4-Morpholin-4-ylsulfonylphenyl)-[2-(pyrrolidin-1-ylmethyl)pyrrolidin-1-yl]methanone
- IUPAC
- (4-morpholin-4-ylsulfonylphenyl)-[2-(pyrrolidin-1-ylmethyl)pyrrolidin-1-yl]methanone
Names & synonyms
SCHEMBL1830219
Database identifiers
- PubChem CID
- 15950872
Properties
Computed structural properties
- XLogP
- 1.2
- Topological polar surface area
- 78.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 5
- Heavy atoms
- 28
- Formal charge
- 0
- Complexity
- 630
Related reactions
1 records
Compound notes
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