N-[4-(morpholine-4-carbonyl)phenyl]-2-{[4-(prop-2-en-1-yl)-5-(thiophen-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Chemical Structure Depiction of
N-[4-(morpholine-4-carbonyl)phenyl]-2-{[4-(prop-2-en-1-yl)-5-(thiophen-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
N-[4-(morpholine-4-carbonyl)phenyl]-2-{[4-(prop-2-en-1-yl)-5-(thiophen-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Compound characteristics
| Compound ID: | 8016-9485 |
| Compound Name: | N-[4-(morpholine-4-carbonyl)phenyl]-2-{[4-(prop-2-en-1-yl)-5-(thiophen-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide |
| Molecular Weight: | 469.58 |
| Molecular Formula: | C22 H23 N5 O3 S2 |
| Smiles: | C=CCn1c(c2cccs2)nnc1SCC(Nc1ccc(cc1)C(N1CCOCC1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.515 |
| logD: | 2.5147 |
| logSw: | -2.7501 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 72.944 |
| InChI Key: | RSBQSCASFJHHLG-UHFFFAOYSA-N |