Basic information
- Standard SMILES
COc1ccccc1Oc1c(Cl)nc(-c2ccncc2)nc1NS(=O)(=O)Nc1ccc(C(C)C)cc1- InChIKey
AWVDRDIUQSUKAI-UHFFFAOYSA-N- Molecular formula
- C25H24ClN5O4S
- Average molar mass
- 526 g/mol
Names & identifiers
- Preferred name
- 4-i-Propyl-phenyl sulfamic acid-[6-chloro-5-(o-methoxy-phenoxy)-2-(4-pyridyl)-4-pyrimidinyl]-amide
- IUPAC
- 6-chloro-5-(2-methoxyphenoxy)-N-[(4-propan-2-ylphenyl)sulfamoyl]-2-pyridin-4-ylpyrimidin-4-amine
Names & synonyms
SCHEMBL5633038AWVDRDIUQSUKAI-UHFFFAOYSA-N4-i-propyl-phenyl sulfamic acid-[6-chloro-5-(o-methoxy-phenoxy)-2-(4-pyridyl)-4-pyrimidinyl]-amide4-i-propyl-phenyl sulfamic acid-[6-chloro-5-(o-methoxyphenoxy)-2-(4-pyridyl)-pyrimidin-4-yl]-amide4-i-propyl-phenyl sulfamic acid-[6-chloro-5-(o-methoxyphenoxy)-2-(4-pyridyl)pyrimidin-4-yl]-amide
Database identifiers
- PubChem CID
- 10279868
Properties
Computed structural properties
- XLogP
- 5
- Topological polar surface area
- 124 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 9
- Rotatable bonds
- 9
- Heavy atoms
- 36
- Formal charge
- 0
- Complexity
- 771
Related reactions
11 records
Compound notes
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