Basic information
- Standard SMILES
CCCCC(=O)N(Cc1ccc(-c2ccccc2-c2nnn(C(c3ccccc3)(c3ccccc3)c3ccccc3)n2)cc1)C(C(=O)O)C(C)C- InChIKey
HQCWKLWGCQAUOU-UHFFFAOYSA-N- Molecular formula
- C43H43N5O3
- Average molar mass
- 677.8 g/mol
- Monoisotopic mass
- 677.33659025
Names & identifiers
- Preferred name
- Triphyl valsartan
- IUPAC
- 3-methyl-2-[pentanoyl-[[4-[2-(2-trityltetrazol-5-yl)phenyl]phenyl]methyl]amino]butanoic acid
Names & synonyms
Triphyl valsartanC43H43N5O3SCHEMBL2930431SB673673-methyl-2-[pentanoyl-[[4-[2-(2-trityltetrazol-5-yl)phenyl]phenyl]methyl]amino]butanoic acid
Database identifiers
- PubChem CID
- 68445159
Properties
Computed structural properties
- XLogP
- 9.8
- Topological polar surface area
- 101 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 14
- Heavy atoms
- 51
- Formal charge
- 0
- Complexity
- 1,030
Related reactions
1 records
Compound notes
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