Basic information
- Standard SMILES
CCOC(=O)N1CCN(C(=O)C(CCC(=O)OC)NC(=O)c2cc(OC3(C(=O)OCC)CCC3)n(-c3ccccc3)n2)CC1- InChIKey
GNMHSTPIFZZQRP-UHFFFAOYSA-N- Molecular formula
- C30H39N5O9
- Average molar mass
- 613.7 g/mol
Names & identifiers
- Preferred name
- Ethyl 4-[2-[[5-(1-ethoxycarbonylcyclobutyl)oxy-1-phenylpyrazole-3-carbonyl]amino]-5-methoxy-5-oxopentanoyl]piperazine-1-carboxylate
- IUPAC
- ethyl 4-[2-[[5-(1-ethoxycarbonylcyclobutyl)oxy-1-phenylpyrazole-3-carbonyl]amino]-5-methoxy-5-oxopentanoyl]piperazine-1-carboxylate
Names & synonyms
SCHEMBL1144313
Database identifiers
- PubChem CID
- 66920341
Properties
Computed structural properties
- XLogP
- 2.6
- Topological polar surface area
- 159 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 10
- Rotatable bonds
- 15
- Heavy atoms
- 44
- Formal charge
- 0
- Complexity
- 1,020
Related reactions
1 records
Compound notes
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