N-(2-{[(4-fluorophenyl)methyl][(thiophen-2-yl)methyl]amino}-2-oxoethyl)-N-(2-methoxyethyl)-3,5-dinitrobenzamide
Chemical Structure Depiction of
N-(2-{[(4-fluorophenyl)methyl][(thiophen-2-yl)methyl]amino}-2-oxoethyl)-N-(2-methoxyethyl)-3,5-dinitrobenzamide
N-(2-{[(4-fluorophenyl)methyl][(thiophen-2-yl)methyl]amino}-2-oxoethyl)-N-(2-methoxyethyl)-3,5-dinitrobenzamide
Compound characteristics
| Compound ID: | V012-3063 |
| Compound Name: | N-(2-{[(4-fluorophenyl)methyl][(thiophen-2-yl)methyl]amino}-2-oxoethyl)-N-(2-methoxyethyl)-3,5-dinitrobenzamide |
| Molecular Weight: | 530.53 |
| Molecular Formula: | C24 H23 F N4 O7 S |
| Smiles: | COCCN(CC(N(Cc1ccc(cc1)F)Cc1cccs1)=O)C(c1cc(cc(c1)[N+]([O-])=O)[N+]([O-])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.1809 |
| logD: | 3.1809 |
| logSw: | -3.3346 |
| Hydrogen bond acceptors count: | 13 |
| Polar surface area: | 108.235 |
| InChI Key: | AJBVHZLAQXXSKQ-UHFFFAOYSA-N |