Basic information
- Standard SMILES
CCCn1cc(CC(NC(=O)OC(C)(C)C)C(=O)O)c2ccccc21- InChIKey
NPCAMEFIFAARMW-UHFFFAOYSA-N- Molecular formula
- C19H26N2O4
- Average molar mass
- 346.4 g/mol
Names & identifiers
- Preferred name
- 2-[(2-Methylpropan-2-yl)oxycarbonylamino]-3-(1-propylindol-3-yl)propanoic acid
- IUPAC
- 2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-(1-propylindol-3-yl)propanoic acid
Names & synonyms
SCHEMBL2839750
Database identifiers
- PubChem CID
- 23148271
Properties
Computed structural properties
- XLogP
- 3.4
- Topological polar surface area
- 80.6 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 8
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 475
Related reactions
2 records
Compound notes
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