Completing data — refresh the page later to see the latest
Basic information
- Standard SMILES
C[C@]1(CN2CCN(Cc3ccc(-c4ccc(C(F)(F)F)cc4)cc3)CC2)Cn2cc([N+](=O)[O-])nc2O1- InChIKey
VVIPVTJEVUGSRO-DEOSSOPVSA-N- Molecular formula
- C25H26F3N5O3
- Average molar mass
- 501.5 g/mol
Names & identifiers
- Preferred name
- (S)-2-methyl-6-nitro-2-[4-(4'-trifluoromethylbiphenyl-4-ylmethyl)piperazin-1-ylmethyl]-2,3-dihydroimidazo[2,1-b]oxazole
- IUPAC
- (2S)-2-methyl-6-nitro-2-[[4-[[4-[4-(trifluoromethyl)phenyl]phenyl]methyl]piperazin-1-yl]methyl]-3H-imidazo[2,1-b][1,3]oxazole
Names & synonyms
(S)-2-methyl-6-nitro-2-[4-(4'-trifluoromethylbiphenyl-4-ylmethyl)piperazin-1-ylmethyl]-2,3-dihydroimidazo[2,1-b]oxazoleSCHEMBL5541376
Database identifiers
- PubChem CID
- 10097539
Properties
Computed structural propertiesFilling in
- XLogP
- 4.3
- Topological polar surface area
- 79.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 9
- Rotatable bonds
- 5
- Heavy atoms
- 36
- Formal charge
- 0
- Complexity
- 759
Related reactions
1 records
Compound notes
Loading…