N-(2-{[(4-fluorophenyl)methyl][(furan-2-yl)methyl]amino}-2-oxoethyl)-4-nitro-N-(prop-2-en-1-yl)benzamide
Chemical Structure Depiction of
N-(2-{[(4-fluorophenyl)methyl][(furan-2-yl)methyl]amino}-2-oxoethyl)-4-nitro-N-(prop-2-en-1-yl)benzamide
N-(2-{[(4-fluorophenyl)methyl][(furan-2-yl)methyl]amino}-2-oxoethyl)-4-nitro-N-(prop-2-en-1-yl)benzamide
Compound characteristics
| Compound ID: | V012-0125 |
| Compound Name: | N-(2-{[(4-fluorophenyl)methyl][(furan-2-yl)methyl]amino}-2-oxoethyl)-4-nitro-N-(prop-2-en-1-yl)benzamide |
| Molecular Weight: | 451.45 |
| Molecular Formula: | C24 H22 F N3 O5 |
| Smiles: | C=CCN(CC(N(Cc1ccc(cc1)F)Cc1ccco1)=O)C(c1ccc(cc1)[N+]([O-])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.4143 |
| logD: | 3.4143 |
| logSw: | -3.5573 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 73.242 |
| InChI Key: | OFNSBCXTGRQDGA-UHFFFAOYSA-N |