Basic information
- Standard SMILES
COc1cc(C)c(S(=O)(=O)N(Cc2nnc(C(=O)N3CCC(CCN4CCCC4)CC3)s2)C2CC2)c(C)c1- InChIKey
MJWBQALIYZRRIE-UHFFFAOYSA-N- Molecular formula
- C27H39N5O4S2
- Average molar mass
- 561.8 g/mol
Names & identifiers
- Preferred name
- N-Cyclopropyl-4-methoxy-2,6-dimethyl-N-[(5-{[4-(2-pyrrolidin-1-ylethyl)piperidin-1-yl]carbonyl}-1,3,4-thiadiazol-2-yl)methyl]benzenesulfonamide
- IUPAC
- N-cyclopropyl-4-methoxy-2,6-dimethyl-N-[[5-[4-(2-pyrrolidin-1-ylethyl)piperidine-1-carbonyl]-1,3,4-thiadiazol-2-yl]methyl]benzenesulfonamide
Names & synonyms
SCHEMBL2234950MJWBQALIYZRRIE-UHFFFAOYSA-NN-Cyclopropyl-4-methoxy-2,6-dimethyl-N-[(5-{[4-(2-pyrrolidin-1-ylethyl)piperidin-1-yl]carbonyl}-1,3,4-thiadiazol-2-yl)methyl]benzenesulfonamide
Database identifiers
- PubChem CID
- 58393259
Properties
Computed structural properties
- XLogP
- 3.7
- Topological polar surface area
- 133 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 9
- Rotatable bonds
- 10
- Heavy atoms
- 38
- Formal charge
- 0
- Complexity
- 888
Related reactions
1 records
Compound notes
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