ethyl 3-(3-nitrophenyl)-3-[(2,4,6-trimethylbenzene-1-sulfonyl)amino]propanoate
Chemical Structure Depiction of
ethyl 3-(3-nitrophenyl)-3-[(2,4,6-trimethylbenzene-1-sulfonyl)amino]propanoate
ethyl 3-(3-nitrophenyl)-3-[(2,4,6-trimethylbenzene-1-sulfonyl)amino]propanoate
Compound characteristics
| Compound ID: | 8013-2114 |
| Compound Name: | ethyl 3-(3-nitrophenyl)-3-[(2,4,6-trimethylbenzene-1-sulfonyl)amino]propanoate |
| Molecular Weight: | 420.48 |
| Molecular Formula: | C20 H24 N2 O6 S |
| Smiles: | CCOC(CC(c1cccc(c1)[N+]([O-])=O)NS(c1c(C)cc(C)cc1C)(=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.5062 |
| logD: | 4.5048 |
| logSw: | -4.3069 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 95.381 |
| InChI Key: | NXUDYHGOUCMOCI-SFHVURJKSA-N |