3-methyl-N-[(4-nitrophenyl)methyl]-N-[(1-{[4-(trifluoromethyl)phenyl]methyl}-1H-pyrrol-2-yl)methyl]butan-1-amine
Chemical Structure Depiction of
3-methyl-N-[(4-nitrophenyl)methyl]-N-[(1-{[4-(trifluoromethyl)phenyl]methyl}-1H-pyrrol-2-yl)methyl]butan-1-amine
3-methyl-N-[(4-nitrophenyl)methyl]-N-[(1-{[4-(trifluoromethyl)phenyl]methyl}-1H-pyrrol-2-yl)methyl]butan-1-amine
Compound characteristics
| Compound ID: | V024-5857 |
| Compound Name: | 3-methyl-N-[(4-nitrophenyl)methyl]-N-[(1-{[4-(trifluoromethyl)phenyl]methyl}-1H-pyrrol-2-yl)methyl]butan-1-amine |
| Molecular Weight: | 459.51 |
| Molecular Formula: | C25 H28 F3 N3 O2 |
| Salt: | not_available |
| Smiles: | CC(C)CCN(Cc1ccc(cc1)[N+]([O-])=O)Cc1cccn1Cc1ccc(cc1)C(F)(F)F |
| Stereo: | ACHIRAL |
| logP: | 6.5178 |
| logD: | 6.4202 |
| logSw: | -5.9058 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 39.38 |
| InChI Key: | PLPJZFZDRQBDLB-UHFFFAOYSA-N |