Basic information
- Standard SMILES
COc1cc(OC)c(Cl)c(NC(=O)Nc2cc(Nc3ccc(OCCN4CCOCC4)cc3)ncn2)c1Cl- InChIKey
FHNJKNLVPVRJHU-UHFFFAOYSA-N- Molecular formula
- C25H28Cl2N6O5
- Average molar mass
- 563.4 g/mol
Names & identifiers
- Preferred name
- 1-(2,6-Dichloro-3,5-dimethoxy-phenyl)-3-{6-[4-(2-morpholin-4-yl-ethoxy)phenylamino]-pyrimidin-4-yl}-urea
- IUPAC
- 1-(2,6-dichloro-3,5-dimethoxyphenyl)-3-[6-[4-(2-morpholin-4-ylethoxy)anilino]pyrimidin-4-yl]urea
Names & synonyms
SCHEMBL2010223FHNJKNLVPVRJHU-UHFFFAOYSA-N1-(2,6-Dichloro-3,5-dimethoxy-phenyl)-3-{6-[4-(2-morpholin-4-yl-ethoxy)phenylamino]-pyrimidin-4-yl}-urea
Database identifiers
- PubChem CID
- 23630278
Properties
Computed structural properties
- XLogP
- 3.8
- Topological polar surface area
- 119 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 9
- Rotatable bonds
- 10
- Heavy atoms
- 38
- Formal charge
- 0
- Complexity
- 700
Related reactions
3 records
Compound notes
Loading…