Basic information
- Standard SMILES
COc1ccccc1Oc1c(Cl)nc(C)nc1NS(=O)(=O)c1ccc(C(C)C)cn1- InChIKey
NIRMOAIABKEPFS-UHFFFAOYSA-N- Molecular formula
- C20H21ClN4O4S
- Average molar mass
- 448.9 g/mol
- Monoisotopic mass
- 448.097204
Names & identifiers
- Preferred name
- 5-isopropyl-N-[6-chloro-5-(o-methoxyphenoxy)-2-methyl-4-pyrimidinyl]-2-pyridine sulfonamide
- IUPAC
- N-[6-chloro-5-(2-methoxyphenoxy)-2-methylpyrimidin-4-yl]-5-propan-2-ylpyridine-2-sulfonamide
Names & synonyms
SCHEMBL6785297NIRMOAIABKEPFS-UHFFFAOYSA-N5-isopropyl-N-[6-chloro-5-(o-methoxyphenoxy)-2-methyl-4-pyrimidinyl]-2-pyridine sulfonamide
Database identifiers
- PubChem CID
- 22729401
Properties
Computed structural properties
- XLogP
- 4.3
- Topological polar surface area
- 112 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 7
- Heavy atoms
- 30
- Formal charge
- 0
- Complexity
- 647
Related reactions
2 records
Compound notes
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