Basic information
- Standard SMILES
C=CCNc1nc(NCCCCC)c2cc([N+](=O)[O-])ccc2n1- InChIKey
QYZWEVYAHDOTLD-UHFFFAOYSA-N- Molecular formula
- C16H21N5O2
- Average molar mass
- 315.37 g/mol
Names & identifiers
- Preferred name
- 6-nitro-4-N-pentyl-2-N-prop-2-enylquinazoline-2,4-diamine
- IUPAC
- 6-nitro-4-N-pentyl-2-N-prop-2-enylquinazoline-2,4-diamine
Database identifiers
- PubChem CID
- 18326484
Properties
Computed structural properties
- XLogP
- 4.4
- Topological polar surface area
- 95.7 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 8
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 387
Related reactions
1 records
Compound notes
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