methyl 4-{[N-(4-methylphenyl)-N-(1,3,5-trimethyl-1H-pyrazole-4-sulfonyl)glycyl]amino}benzoate
Chemical Structure Depiction of
methyl 4-{[N-(4-methylphenyl)-N-(1,3,5-trimethyl-1H-pyrazole-4-sulfonyl)glycyl]amino}benzoate
methyl 4-{[N-(4-methylphenyl)-N-(1,3,5-trimethyl-1H-pyrazole-4-sulfonyl)glycyl]amino}benzoate
Compound characteristics
| Compound ID: | C517-1293 |
| Compound Name: | methyl 4-{[N-(4-methylphenyl)-N-(1,3,5-trimethyl-1H-pyrazole-4-sulfonyl)glycyl]amino}benzoate |
| Molecular Weight: | 470.55 |
| Molecular Formula: | C23 H26 N4 O5 S |
| Smiles: | Cc1ccc(cc1)N(CC(Nc1ccc(cc1)C(=O)OC)=O)S(c1c(C)nn(C)c1C)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.733 |
| logD: | 2.7329 |
| logSw: | -3.2704 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 90.955 |
| InChI Key: | IDSWLKCGJHINPW-UHFFFAOYSA-N |