N-tert-butyl-2-({4-methyl-5-[(5-phenyl-2H-tetrazol-2-yl)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)acetamide
Chemical Structure Depiction of
N-tert-butyl-2-({4-methyl-5-[(5-phenyl-2H-tetrazol-2-yl)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)acetamide
N-tert-butyl-2-({4-methyl-5-[(5-phenyl-2H-tetrazol-2-yl)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)acetamide
Compound characteristics
| Compound ID: | 8016-2626 |
| Compound Name: | N-tert-butyl-2-({4-methyl-5-[(5-phenyl-2H-tetrazol-2-yl)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)acetamide |
| Molecular Weight: | 386.48 |
| Molecular Formula: | C17 H22 N8 O S |
| Smiles: | CC(C)(C)NC(CSc1nnc(Cn2nc(c3ccccc3)nn2)n1C)=O |
| Stereo: | ACHIRAL |
| logP: | 1.6141 |
| logD: | 1.6134 |
| logSw: | -2.3931 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 87.969 |
| InChI Key: | VCDCOXVCFLLPAH-UHFFFAOYSA-N |