Basic information
- Standard SMILES
O=C(NCc1ccc(Cl)c(Cl)c1)c1cnc(C(=O)NOCc2ccccc2)c(OCc2ccccc2)c1CO- InChIKey
WNKSQLOELQBBNL-UHFFFAOYSA-N- Molecular formula
- C29H25Cl2N3O5
- Average molar mass
- 566.4 g/mol
Names & identifiers
- Preferred name
- N2,3-bis(benzyloxy)-N5-(3,4-dichlorobenzyl)-4-(hydroxymethyl)pyridine-2,5-dicarboxamide
- IUPAC
- 5-N-[(3,4-dichlorophenyl)methyl]-4-(hydroxymethyl)-2-N,3-bis(phenylmethoxy)pyridine-2,5-dicarboxamide
Names & synonyms
SCHEMBL12516470WNKSQLOELQBBNL-UHFFFAOYSA-NN2, 3-bis(benzyloxy)-N5-(3,4-dichlorobenzyl)-4-(hydroxymethyl)pyridine-2,5-dicarboxamideN2,3-bis(benzyloxy)-N5-(3,4-dichlorobenzyl)-4-(hydroxymethyl)pyridine-2,5-dicarboxamideN2,3-dibenzyloxy-N5-[(3,4-dichlorophenyl)methyl]-4-(hydroxymethyl)pyridine-2,5-dicarboxamide
Database identifiers
- PubChem CID
- 44539697
Properties
Computed structural properties
- XLogP
- 4.6
- Topological polar surface area
- 110 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 11
- Heavy atoms
- 39
- Formal charge
- 0
- Complexity
- 765
Related reactions
2 records
Compound notes
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