2-{2-bromo-6-ethoxy-4-[({2-[(1-methyl-1H-tetrazol-5-yl)sulfanyl]ethyl}amino)methyl]phenoxy}acetamide--hydrogen chloride (1/1)
Chemical Structure Depiction of
2-{2-bromo-6-ethoxy-4-[({2-[(1-methyl-1H-tetrazol-5-yl)sulfanyl]ethyl}amino)methyl]phenoxy}acetamide--hydrogen chloride (1/1)
2-{2-bromo-6-ethoxy-4-[({2-[(1-methyl-1H-tetrazol-5-yl)sulfanyl]ethyl}amino)methyl]phenoxy}acetamide--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | 8104-04780 |
| Compound Name: | 2-{2-bromo-6-ethoxy-4-[({2-[(1-methyl-1H-tetrazol-5-yl)sulfanyl]ethyl}amino)methyl]phenoxy}acetamide--hydrogen chloride (1/1) |
| Molecular Weight: | 481.8 |
| Molecular Formula: | C15 H21 Br N6 O3 S |
| Salt: | HCl |
| Smiles: | [H]N(CCSc1nnnn1C)Cc1cc(c(c(c1)[Br])OCC(N)=O)OCC |
| Stereo: | ACHIRAL |
| logP: | 0.4664 |
| logD: | -3.8296 |
| logSw: | -1.9162 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 100.46 |
| InChI Key: | RFHLYJRGBCBBIA-UHFFFAOYSA-N |