1-(1H-indol-3-yl)-2-({4-phenyl-5-[(thiophen-2-yl)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)ethan-1-one
Chemical Structure Depiction of
1-(1H-indol-3-yl)-2-({4-phenyl-5-[(thiophen-2-yl)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)ethan-1-one
1-(1H-indol-3-yl)-2-({4-phenyl-5-[(thiophen-2-yl)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)ethan-1-one
Compound characteristics
| Compound ID: | 7525-0943 |
| Compound Name: | 1-(1H-indol-3-yl)-2-({4-phenyl-5-[(thiophen-2-yl)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)ethan-1-one |
| Molecular Weight: | 430.55 |
| Molecular Formula: | C23 H18 N4 O S2 |
| Smiles: | C(c1nnc(n1c1ccccc1)SCC(c1c[nH]c2ccccc12)=O)c1cccs1 |
| Stereo: | ACHIRAL |
| logP: | 4.5286 |
| logD: | 4.5286 |
| logSw: | -4.452 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 49.825 |
| InChI Key: | VKKYVDOQNSYZHJ-UHFFFAOYSA-N |