4-({[5-(methoxymethyl)-4-(1-methoxypropan-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-N-(2-methylpropyl)benzamide
Chemical Structure Depiction of
4-({[5-(methoxymethyl)-4-(1-methoxypropan-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-N-(2-methylpropyl)benzamide
4-({[5-(methoxymethyl)-4-(1-methoxypropan-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-N-(2-methylpropyl)benzamide
Compound characteristics
| Compound ID: | V030-7121 |
| Compound Name: | 4-({[5-(methoxymethyl)-4-(1-methoxypropan-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-N-(2-methylpropyl)benzamide |
| Molecular Weight: | 406.55 |
| Molecular Formula: | C20 H30 N4 O3 S |
| Smiles: | CC(C)CNC(c1ccc(CSc2nnc(COC)n2C(C)COC)cc1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.7762 |
| logD: | 1.7762 |
| logSw: | -2.3634 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 67.681 |
| InChI Key: | PPHWPIXHNXZUFD-HNNXBMFYSA-N |