2-chloro-5-phenyl-N-(pyridin-2-ylmethyl)pyrrolo[2,1-f][1,2,4]triazin-4-amine
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Basic information
- Standard SMILES
Clc1nc(NCc2ccccn2)c2c(-c3ccccc3)ccn2n1- InChIKey
PYOPMHRSBZLJOZ-UHFFFAOYSA-N- Molecular formula
- C18H14ClN5
- Average molar mass
- 335.8 g/mol
- Monoisotopic mass
- 335.0937732
Names & identifiers
- Preferred name
- 2-chloro-5-phenyl-N-(pyridin-2-ylmethyl)pyrrolo[2,1-f][1,2,4]triazin-4-amine
- IUPAC
- 2-chloro-5-phenyl-N-(pyridin-2-ylmethyl)pyrrolo[2,1-f][1,2,4]triazin-4-amine
Names & synonyms
SCHEMBL16007141PYOPMHRSBZLJOZ-UHFFFAOYSA-N2-chloro-5-phenyl-N-(pyridin-2-ylmethyl)pyrrolo[2,1-f][1,2,4]triazin-4-amine
Database identifiers
- PubChem CID
- 90386157
Properties
Computed structural propertiesFilling in
- XLogP
- 3.8
- Topological polar surface area
- 55.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 403
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Related reactions
4 records
Compound notes
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