Basic information
- Standard SMILES
Cc1nn(-c2ccc(CCNC(=O)NS(=O)(=O)c3ncccc3Cl)cc2)c(C)c1-c1ccccc1- InChIKey
KHPSZBAFNZYVOU-UHFFFAOYSA-N- Molecular formula
- C25H24ClN5O3S
- Average molar mass
- 510 g/mol
Names & identifiers
- Preferred name
- 3-Chloro-N-[({2-[4-(3,5-dimethyl-4-phenyl-1H-pyrazol-1-yl)phenyl]ethyl}amino)carbonyl]-2-pyridinesulfonamide
- IUPAC
- 1-[(3-chloro-2-pyridinyl)sulfonyl]-3-[2-[4-(3,5-dimethyl-4-phenylpyrazol-1-yl)phenyl]ethyl]urea
Names & synonyms
SCHEMBL6097683KHPSZBAFNZYVOU-UHFFFAOYSA-N3-Chloro-N-[({2-[4-(3,5-dimethyl-4-phenyl-1H-pyrazol-1-yl)phenyl]ethyl}amino)carbonyl]-2-pyridinesulfonamide
Database identifiers
- PubChem CID
- 22244682
Properties
Computed structural properties
- XLogP
- 4.7
- Topological polar surface area
- 114 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 7
- Heavy atoms
- 35
- Formal charge
- 0
- Complexity
- 795
Related reactions
2 records
Compound notes
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