Basic information
- Standard SMILES
CCOC(=O)c1ccc(NN2CN(Nc3ccc(C(=O)OCC)cc3)CN(Nc3ccc(C(=O)OCC)cc3)C2)cc1- InChIKey
LBBBGQOYVTWCCT-UHFFFAOYSA-N- Molecular formula
- C30H36N6O6
- Average molar mass
- 576.6 g/mol
Names & identifiers
- Preferred name
- 1,3,5-Tris-(p-ethoxycarbonylanilino)-s-triazine
- IUPAC
- ethyl 4-[[3,5-bis(4-ethoxycarbonylanilino)-1,3,5-triazinan-1-yl]amino]benzoate
Names & synonyms
SCHEMBL10666828LBBBGQOYVTWCCT-UHFFFAOYSA-N1,3,5-tris-(p-ethoxycarbonylanilino)-s-triazine
Database identifiers
- PubChem CID
- 20152738
Properties
Computed structural properties
- XLogP
- 6.7
- Topological polar surface area
- 125 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 12
- Rotatable bonds
- 15
- Heavy atoms
- 42
- Formal charge
- 0
- Complexity
- 734
Related reactions
1 records
Compound notes
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