ethyl 3-{[2,5-dimethyl-4-(3-methyl-1H-pyrazol-5-yl)thiophene-3-sulfonyl]amino}benzoate
Chemical Structure Depiction of
ethyl 3-{[2,5-dimethyl-4-(3-methyl-1H-pyrazol-5-yl)thiophene-3-sulfonyl]amino}benzoate
ethyl 3-{[2,5-dimethyl-4-(3-methyl-1H-pyrazol-5-yl)thiophene-3-sulfonyl]amino}benzoate
Compound characteristics
| Compound ID: | M332-0051 |
| Compound Name: | ethyl 3-{[2,5-dimethyl-4-(3-methyl-1H-pyrazol-5-yl)thiophene-3-sulfonyl]amino}benzoate |
| Molecular Weight: | 419.52 |
| Molecular Formula: | C19 H21 N3 O4 S2 |
| Smiles: | CCOC(c1cccc(c1)NS(c1c(c2cc(C)n[nH]2)c(C)sc1C)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.5186 |
| logD: | 4.4277 |
| logSw: | -4.3486 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 84.956 |
| InChI Key: | GIOFCMUGUTWKPV-UHFFFAOYSA-N |