N,N-dimethyl-2-{[4-methyl-5-(phenoxymethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Chemical Structure Depiction of
N,N-dimethyl-2-{[4-methyl-5-(phenoxymethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
N,N-dimethyl-2-{[4-methyl-5-(phenoxymethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Compound characteristics
| Compound ID: | 8014-2675 |
| Compound Name: | N,N-dimethyl-2-{[4-methyl-5-(phenoxymethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide |
| Molecular Weight: | 306.38 |
| Molecular Formula: | C14 H18 N4 O2 S |
| Smiles: | CN(C)C(CSc1nnc(COc2ccccc2)n1C)=O |
| Stereo: | ACHIRAL |
| logP: | 0.6787 |
| logD: | 0.6787 |
| logSw: | -1.6883 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 49.271 |
| InChI Key: | KZEJFZZNZNQLFM-UHFFFAOYSA-N |