Basic information
- Standard SMILES
CCOC(=O)C[C@H](NC(=O)[C@H](CC(C)C)N1C(=O)N(Cc2ccc(NC(=O)Nc3ccccc3C)c(OC)c2)C(C(F)(F)F)(C(F)(F)F)C1=O)c1ccccc1- InChIKey
ZXNJHSUGEGVQGF-VMPREFPWSA-N- Molecular formula
- C38H41F6N5O7
- Average molar mass
- 793.8 g/mol
Names & identifiers
- Preferred name
- Ethyl (s)-3-((s)-2-(4,4-bis(trifluoromethyl)-3-(4-(3-(2-methylphenyl)ureido)-3-methoxybenzyl)-2,5-dioxoimidazolidin-1-yl)-2-(2-methylpropyl)acetylamino)-3-phenylpropionate
- IUPAC
- ethyl (3S)-3-[[(2S)-2-[3-[[3-methoxy-4-[(2-methylphenyl)carbamoylamino]phenyl]methyl]-2,5-dioxo-4,4-bis(trifluoromethyl)imidazolidin-1-yl]-4-methylpentanoyl]amino]-3-phenylpropanoate
Names & synonyms
ethyl (s)-3-((s)-2-(4,4-bis(trifluoromethyl)-3-(4-(3-(2-methylphenyl)ureido)-3-methoxybenzyl)-2,5-dioxoimidazolidin-1-yl)-2-(2-methylpropyl)acetylamino)-3-phenylpropionate
Database identifiers
- PubChem CID
- 91066696
Properties
Computed structural properties
- XLogP
- 6.6
- Topological polar surface area
- 146 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 13
- Rotatable bonds
- 15
- Heavy atoms
- 56
- Formal charge
- 0
- Complexity
- 1,380
Related reactions
1 records
Compound notes
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