4-{[N-(ethanesulfonyl)-N-(2-methoxyethyl)glycyl][(3-fluorophenyl)methyl]amino}-N-(4-nitrophenyl)piperidine-1-carboxamide
Chemical Structure Depiction of
4-{[N-(ethanesulfonyl)-N-(2-methoxyethyl)glycyl][(3-fluorophenyl)methyl]amino}-N-(4-nitrophenyl)piperidine-1-carboxamide
4-{[N-(ethanesulfonyl)-N-(2-methoxyethyl)glycyl][(3-fluorophenyl)methyl]amino}-N-(4-nitrophenyl)piperidine-1-carboxamide
Compound characteristics
| Compound ID: | V001-3377 |
| Compound Name: | 4-{[N-(ethanesulfonyl)-N-(2-methoxyethyl)glycyl][(3-fluorophenyl)methyl]amino}-N-(4-nitrophenyl)piperidine-1-carboxamide |
| Molecular Weight: | 579.65 |
| Molecular Formula: | C26 H34 F N5 O7 S |
| Smiles: | CCS(N(CCOC)CC(N(Cc1cccc(c1)F)C1CCN(CC1)C(Nc1ccc(cc1)[N+]([O-])=O)=O)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.6935 |
| logD: | 2.6934 |
| logSw: | -3.0857 |
| Hydrogen bond acceptors count: | 14 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 113.687 |
| InChI Key: | YMBTZYDNFPAMGD-UHFFFAOYSA-N |