5-({[5-(5-methylfuran-2-yl)-1,3,4-oxadiazol-2-yl]methyl}sulfanyl)-4-phenyl-2,4-dihydro-3H-1,2,4-triazol-3-one
Chemical Structure Depiction of
5-({[5-(5-methylfuran-2-yl)-1,3,4-oxadiazol-2-yl]methyl}sulfanyl)-4-phenyl-2,4-dihydro-3H-1,2,4-triazol-3-one
5-({[5-(5-methylfuran-2-yl)-1,3,4-oxadiazol-2-yl]methyl}sulfanyl)-4-phenyl-2,4-dihydro-3H-1,2,4-triazol-3-one
Compound characteristics
| Compound ID: | 8019-0639 |
| Compound Name: | 5-({[5-(5-methylfuran-2-yl)-1,3,4-oxadiazol-2-yl]methyl}sulfanyl)-4-phenyl-2,4-dihydro-3H-1,2,4-triazol-3-one |
| Molecular Weight: | 355.37 |
| Molecular Formula: | C16 H13 N5 O3 S |
| Smiles: | Cc1ccc(c2nnc(CSC3=NNC(N3c3ccccc3)=O)o2)o1 |
| Stereo: | ACHIRAL |
| logP: | 2.7628 |
| logD: | 2.4787 |
| logSw: | -3.0666 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 78.831 |
| InChI Key: | SRIRSAYVOWYKPD-UHFFFAOYSA-N |