Basic information
- Standard SMILES
COc1cc(NC(=O)c2c(Cl)ncnc2Cl)cc(OC)c1- InChIKey
MPVWQUBFTMWSOR-UHFFFAOYSA-N- Molecular formula
- C13H11Cl2N3O3
- Average molar mass
- 328.15 g/mol
Names & identifiers
- Preferred name
- 4,6-Dichloro-N-(3,5-dimethoxyphenyl)-5-pyrimidinecarboxamide
- IUPAC
- 4,6-dichloro-N-(3,5-dimethoxyphenyl)pyrimidine-5-carboxamide
Names & synonyms
SCHEMBL15650443MPVWQUBFTMWSOR-UHFFFAOYSA-NDB-4119184,6-Dichloro-N-(3,5-dimethoxyphenyl)-5-pyrimidinecarboxamide4,6-Dichloro-N-(3,5-dimethoxyphenyl)pyrimidine-5-carboxamide1605329-37-0
Database identifiers
- PubChem CID
- 90103597
Properties
Computed structural properties
- XLogP
- 2.9
- Topological polar surface area
- 73.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 4
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 340
Related reactions
2 records
Compound notes
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