ethyl 3-{[N-(3,5-dimethylphenyl)-N-(1,3,5-trimethyl-1H-pyrazole-4-sulfonyl)glycyl]amino}benzoate
Chemical Structure Depiction of
ethyl 3-{[N-(3,5-dimethylphenyl)-N-(1,3,5-trimethyl-1H-pyrazole-4-sulfonyl)glycyl]amino}benzoate
ethyl 3-{[N-(3,5-dimethylphenyl)-N-(1,3,5-trimethyl-1H-pyrazole-4-sulfonyl)glycyl]amino}benzoate
Compound characteristics
| Compound ID: | F062-0901 |
| Compound Name: | ethyl 3-{[N-(3,5-dimethylphenyl)-N-(1,3,5-trimethyl-1H-pyrazole-4-sulfonyl)glycyl]amino}benzoate |
| Molecular Weight: | 498.6 |
| Molecular Formula: | C25 H30 N4 O5 S |
| Smiles: | CCOC(c1cccc(c1)NC(CN(c1cc(C)cc(C)c1)S(c1c(C)nn(C)c1C)(=O)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.9635 |
| logD: | 3.9635 |
| logSw: | -3.9828 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 90.535 |
| InChI Key: | LSEKCJIEDZEZKK-UHFFFAOYSA-N |