N-tert-butyl-2-{2-ethoxy-4-[({2-[(1-methyl-1H-tetrazol-5-yl)sulfanyl]ethyl}amino)methyl]phenoxy}acetamide
Chemical Structure Depiction of
N-tert-butyl-2-{2-ethoxy-4-[({2-[(1-methyl-1H-tetrazol-5-yl)sulfanyl]ethyl}amino)methyl]phenoxy}acetamide
N-tert-butyl-2-{2-ethoxy-4-[({2-[(1-methyl-1H-tetrazol-5-yl)sulfanyl]ethyl}amino)methyl]phenoxy}acetamide
Compound characteristics
| Compound ID: | 8104-04998 |
| Compound Name: | N-tert-butyl-2-{2-ethoxy-4-[({2-[(1-methyl-1H-tetrazol-5-yl)sulfanyl]ethyl}amino)methyl]phenoxy}acetamide |
| Molecular Weight: | 459.01 |
| Molecular Formula: | C19 H30 N6 O3 S |
| Salt: | HCl |
| Smiles: | [H]N(CCSc1nnnn1C)Cc1ccc(c(c1)OCC)OCC(NC(C)(C)C)=O |
| Stereo: | ACHIRAL |
| logP: | 1.0261 |
| logD: | -3.2699 |
| logSw: | -2.4277 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 90.28 |
| InChI Key: | QWKFINHZQHXILU-UHFFFAOYSA-N |