N-cyclopropyl-N-(2-{[(4-fluorophenyl)methyl][(furan-2-yl)methyl]amino}-2-oxoethyl)-4-nitrobenzamide
Chemical Structure Depiction of
N-cyclopropyl-N-(2-{[(4-fluorophenyl)methyl][(furan-2-yl)methyl]amino}-2-oxoethyl)-4-nitrobenzamide
N-cyclopropyl-N-(2-{[(4-fluorophenyl)methyl][(furan-2-yl)methyl]amino}-2-oxoethyl)-4-nitrobenzamide
Compound characteristics
| Compound ID: | V012-0139 |
| Compound Name: | N-cyclopropyl-N-(2-{[(4-fluorophenyl)methyl][(furan-2-yl)methyl]amino}-2-oxoethyl)-4-nitrobenzamide |
| Molecular Weight: | 451.45 |
| Molecular Formula: | C24 H22 F N3 O5 |
| Smiles: | C1CC1N(CC(N(Cc1ccc(cc1)F)Cc1ccco1)=O)C(c1ccc(cc1)[N+]([O-])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7515 |
| logD: | 3.7515 |
| logSw: | -4.1922 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 72.567 |
| InChI Key: | XVLIKXBUZBYOQT-UHFFFAOYSA-N |