U 10029A
Basic information
- CAS
89139-29-7- Standard SMILES
Cl.OC(CNCc1ccccc1)COc1cccc(C(F)(F)F)c1- InChIKey
MXEXNZRLUKLAGU-UHFFFAOYSA-N- Molecular formula
- C17H19ClF3NO2
- Average molar mass
- 361.8 g/mol
- Monoisotopic mass
- 361.105641
Overview
RN given refers to HCl; phospholipase A2 inhibitor
Names & identifiers
- Preferred name
- U 10029A
- IUPAC
- 1-(benzylamino)-3-[3-(trifluoromethyl)phenoxy]propan-2-ol;hydrochloride
Names & synonyms
89139-29-7U 10029AU-10029-ARefChem:1927762-Propanol, 1-((phenylmethyl)amino)-3-(3-(trifluoromethyl)phenoxy)-, hydrochlorideDTXSID1010086661-(Benzylamino)-3-[3-(trifluoromethyl)phenoxy]propan-2-ol--hydrogen chloride (1/1)
Database identifiers
- CAS
89139-29-7- PubChem CID
- 128940
- DTXSID
DTXSID101008666
Properties
Computed structural properties
- Topological polar surface area
- 41.5 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 7
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 332
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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