Basic information
- Standard SMILES
Clc1cc2c(Nc3ccc4c(cnn4Cc4ccccc4)c3)ncnc2cn1- InChIKey
QNDFCSITSCMNGP-UHFFFAOYSA-N- Molecular formula
- C21H15ClN6
- Average molar mass
- 386.8 g/mol
Names & identifiers
- Preferred name
- (1-Benzyl-1H-indazol-5-yl)-(6-chloropyrido[3,4-d]pyrimidin-4-yl)-amine
- IUPAC
- N-(1-benzylindazol-5-yl)-6-chloropyrido[3,4-d]pyrimidin-4-amine
Names & synonyms
SCHEMBL3318947QNDFCSITSCMNGP-UHFFFAOYSA-N(1-benzyl-1H-indazol-5-yl)-(6-chloro-pyrido[3,4-d]pyrimidin-4-yl)-amine(1-Benzyl-1H-indazol-5-yl)-(6-chloropyrido[3,4-d]pyrimidin-4-yl)-amine
Database identifiers
- PubChem CID
- 21952012
Properties
Computed structural properties
- XLogP
- 4.6
- Topological polar surface area
- 68.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 4
- Heavy atoms
- 28
- Formal charge
- 0
- Complexity
- 515
Related reactions
23 records
Linked notes
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