Basic information
- Standard SMILES
COc1ccc(F)cc1C(C)(C)CC(O)(Cc1cc2cnccc2[nH]1)C(C)C- InChIKey
HRYCRSLZUDLMQP-UHFFFAOYSA-N- Molecular formula
- C23H29FN2O2
- Average molar mass
- 384.5 g/mol
Names & identifiers
- Preferred name
- 5-(5-fluoro-2-methoxyphenyl)-2,5-dimethyl-3-(1H-pyrrolo[3,2-c]pyridin-2-ylmethyl)hexan-3-ol
- IUPAC
- 5-(5-fluoro-2-methoxyphenyl)-2,5-dimethyl-3-(1H-pyrrolo[3,2-c]pyridin-2-ylmethyl)hexan-3-ol
Names & synonyms
SCHEMBL292716HRYCRSLZUDLMQP-UHFFFAOYSA-N5-(5-fluoro-2-methoxyphenyl)-2,5-dimethyl-3-(1H-pyrrolo[3,2-c]pyridin-2-ylmethyl)hexan-3-ol
Database identifiers
- PubChem CID
- 11639586
Properties
Computed structural properties
- XLogP
- 5.1
- Topological polar surface area
- 58.1 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 7
- Heavy atoms
- 28
- Formal charge
- 0
- Complexity
- 515
Related reactions
1 records
Compound notes
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