N-{2-[(adamantan-1-yl)oxy]propyl}-N'-(3-nitrophenyl)urea
Chemical Structure Depiction of
N-{2-[(adamantan-1-yl)oxy]propyl}-N'-(3-nitrophenyl)urea
N-{2-[(adamantan-1-yl)oxy]propyl}-N'-(3-nitrophenyl)urea
Compound characteristics
| Compound ID: | 8018-3842 |
| Compound Name: | N-{2-[(adamantan-1-yl)oxy]propyl}-N'-(3-nitrophenyl)urea |
| Molecular Weight: | 373.45 |
| Molecular Formula: | C20 H27 N3 O4 |
| Smiles: | CC(CNC(Nc1cccc(c1)[N+]([O-])=O)=O)OC12CC3CC(CC(C3)C2)C1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.7556 |
| logD: | 4.7555 |
| logSw: | -4.5304 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 72.774 |
| InChI Key: | YIPKZEZYZAKLCZ-IVKJLDKCSA-N |