methyl 4-(2-{[1-(2-methoxyphenyl)-1H-tetrazol-5-yl]sulfanyl}acetamido)benzoate
Chemical Structure Depiction of
methyl 4-(2-{[1-(2-methoxyphenyl)-1H-tetrazol-5-yl]sulfanyl}acetamido)benzoate
methyl 4-(2-{[1-(2-methoxyphenyl)-1H-tetrazol-5-yl]sulfanyl}acetamido)benzoate
Compound characteristics
| Compound ID: | 8014-9426 |
| Compound Name: | methyl 4-(2-{[1-(2-methoxyphenyl)-1H-tetrazol-5-yl]sulfanyl}acetamido)benzoate |
| Molecular Weight: | 399.43 |
| Molecular Formula: | C18 H17 N5 O4 S |
| Smiles: | COC(c1ccc(cc1)NC(CSc1nnnn1c1ccccc1OC)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.7885 |
| logD: | 2.7884 |
| logSw: | -3.4976 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 91.541 |
| InChI Key: | LHDNQQWGWIEPMU-UHFFFAOYSA-N |