ethyl 4-(2-{[1-(2,4,6-trimethylphenyl)-1H-tetrazol-5-yl]sulfanyl}acetamido)benzoate
Chemical Structure Depiction of
ethyl 4-(2-{[1-(2,4,6-trimethylphenyl)-1H-tetrazol-5-yl]sulfanyl}acetamido)benzoate
ethyl 4-(2-{[1-(2,4,6-trimethylphenyl)-1H-tetrazol-5-yl]sulfanyl}acetamido)benzoate
Compound characteristics
| Compound ID: | 3728-1920 |
| Compound Name: | ethyl 4-(2-{[1-(2,4,6-trimethylphenyl)-1H-tetrazol-5-yl]sulfanyl}acetamido)benzoate |
| Molecular Weight: | 425.51 |
| Molecular Formula: | C21 H23 N5 O3 S |
| Smiles: | CCOC(c1ccc(cc1)NC(CSc1nnnn1c1c(C)cc(C)cc1C)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.3054 |
| logD: | 5.3053 |
| logSw: | -5.2498 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 83.19 |
| InChI Key: | GOYMSEXNAHYOME-UHFFFAOYSA-N |