Basic information
- Standard SMILES
CC(=O)N1CC(C)CC1c1cc2[nH]c(-c3ccccn3)nc2cc1Oc1ccc(S(C)(=O)=O)cc1- InChIKey
DZWFCZRUGFCSNT-UHFFFAOYSA-N- Molecular formula
- C26H26N4O4S
- Average molar mass
- 490.6 g/mol
Names & identifiers
- Preferred name
- 6-(1-acetyl-4-methylpyrrolidin-2-yl)-5-(4-(methanesulfonyl)phenoxy)-2-pyridin-2-yl-1H-benzimidazole
- IUPAC
- 1-[4-methyl-2-[6-(4-methylsulfonylphenoxy)-2-pyridin-2-yl-3H-benzimidazol-5-yl]pyrrolidin-1-yl]ethanone
Names & synonyms
SCHEMBL2644703DZWFCZRUGFCSNT-UHFFFAOYSA-N6-(1-acetyl-4-methylpyrrolidin-2-yl)-5-(4-(methanesulfonyl)phenoxy)-2-pyridin-2-yl-1H-benzimidazole
Database identifiers
- PubChem CID
- 23145296
Properties
Computed structural properties
- XLogP
- 3.1
- Topological polar surface area
- 114 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 5
- Heavy atoms
- 35
- Formal charge
- 0
- Complexity
- 856
Related reactions
1 records
Compound notes
Loading…