Basic information
- Standard SMILES
CCOC(=O)CN(C(=O)OC(C)(C)C)C(Cc1ccc(OC)cc1)C(=O)N1CCCC1C(=O)NCc1ccc2c(N)nccc2c1- InChIKey
UACYFPNMMHNBCP-UHFFFAOYSA-N- Molecular formula
- C34H43N5O7
- Average molar mass
- 633.7 g/mol
- Monoisotopic mass
- 633.31624873
Names & identifiers
- IUPAC
- ethyl 2-[[1-[2-[(1-aminoisoquinolin-6-yl)methylcarbamoyl]pyrrolidin-1-yl]-3-(4-methoxyphenyl)-1-oxopropan-2-yl]-[(2-methylpropan-2-yl)oxycarbonyl]amino]acetate
Database identifiers
- PubChem CID
- 76487600
Properties
Computed structural properties
- XLogP
- 4.1
- Topological polar surface area
- 153 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 9
- Rotatable bonds
- 14
- Heavy atoms
- 46
- Formal charge
- 0
- Complexity
- 1,040
Related reactions
2 records
Compound notes
Loading…