Basic information
- Standard SMILES
COC(=O)C(C)NCc1c[nH]c2c(-c3noc(-c4ccc(OC(C)C)c(Cl)c4)n3)cccc12- InChIKey
XFDBOYVMWACERX-UHFFFAOYSA-N- Molecular formula
- C24H25ClN4O4
- Average molar mass
- 468.9 g/mol
- Monoisotopic mass
- 468.156433
Names & identifiers
- IUPAC
- methyl 2-[[7-[5-(3-chloro-4-propan-2-yloxyphenyl)-1,2,4-oxadiazol-3-yl]-1H-indol-3-yl]methylamino]propanoate
Database identifiers
- PubChem CID
- 72528323
Properties
Computed structural properties
- XLogP
- 4.7
- Topological polar surface area
- 102 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 9
- Heavy atoms
- 33
- Formal charge
- 0
- Complexity
- 656
Related reactions
2 records
Compound notes
Loading…