Basic information
- Standard SMILES
O=C1Cc2c(ncnc2Nc2ccc(F)c(Cl)c2)N1- InChIKey
ZUZMVACUXKYXTJ-UHFFFAOYSA-N- Molecular formula
- C12H8ClFN4O
- Average molar mass
- 278.67 g/mol
Names & identifiers
- Preferred name
- 4-(3-Chloro 4-fluoro-phenylamino)-5,7-dihydro-pyrrolo[2,3-d]pyrimidin-6-one
- IUPAC
- 4-(3-chloro-4-fluoroanilino)-5,7-dihydropyrrolo[2,3-d]pyrimidin-6-one
Names & synonyms
4-(3-chloro-4-fluoro-phenylamino)-5,7-dihydro-pyrrolo (2,3-d]pyrimidin-6-one4-(3-chloro-4-fluoro-phenylamino)-5,7-dihydro-pyrrolo [2,3-d]pyrimidin-6-oneSCHEMBL150580ZUZMVACUXKYXTJ-UHFFFAOYSA-N4-(3-chloro 4-fluoro-phenylamino)-5,7-dihydro-pyrrolo[2,3-d]pyrimidin-6-one4-(3-chloro-4-fluoro-phenylamino)-5,7-dihydro-pyrrol[2,3-d]pyrimidin-6-one4-(3-chloro-4-fluoro-phenylamino)-5,7-dihydro-pyrrolo[2,3- d]pyrimidin-6-one4-(3-chloro-4-fluoro-phenylamino)-5,7-dihydro-pyrrolo[2,3-d ]pyrimidin-6-one4-(3-chloro-4-fluoro-phenylamino)-5,7-dihydro-pyrrolo[2,3-d]-pyrimidin-6-one4-(3-chloro-4-fluoro-phenylamino)-5,7-dihydro-pyrrolo[2,3-d]pyrimidin-6-one
Database identifiers
- PubChem CID
- 9878769
- Nikkaji
- J1.774.756H
Properties
Computed structural properties
- XLogP
- 2
- Topological polar surface area
- 66.9 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 2
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 359
Related reactions
85 records
Compound notes
Loading…