Basic information
- Standard SMILES
CCOC(=O)CC1(c2ccc(-c3ccc(-c4ccsc4C(O)CCCc4ccccc4)cc3)cc2)CC1- InChIKey
DRMXCABOTFAGKP-UHFFFAOYSA-N- Molecular formula
- C33H34O3S
- Average molar mass
- 510.7 g/mol
Names & identifiers
- Preferred name
- (1-{4'-[2-(1-Hydroxy-4-phenyl-butyl)-thiophen-3-yl]-biphenyl-4-yl}-cyclopropyl)-acetic acid ethyl ester
- IUPAC
- ethyl 2-[1-[4-[4-[2-(1-hydroxy-4-phenylbutyl)thiophen-3-yl]phenyl]phenyl]cyclopropyl]acetate
Names & synonyms
SCHEMBL9900187DRMXCABOTFAGKP-UHFFFAOYSA-N(1-{4'-[2-(1-Hydroxy-4-phenyl-butyl)-thiophen-3-yl]-biphenyl-4-yl}-cyclopropyl)-acetic acid ethyl ester
Database identifiers
- PubChem CID
- 67958069
Properties
Computed structural properties
- XLogP
- 7.8
- Topological polar surface area
- 74.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 12
- Heavy atoms
- 37
- Formal charge
- 0
- Complexity
- 698
Related reactions
1 records
Compound notes
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