3-(3-{[(5-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]methyl}-1,2,4-oxadiazol-5-yl)-N-(1,3-thiazol-2-yl)propanamide
Chemical Structure Depiction of
3-(3-{[(5-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]methyl}-1,2,4-oxadiazol-5-yl)-N-(1,3-thiazol-2-yl)propanamide
3-(3-{[(5-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]methyl}-1,2,4-oxadiazol-5-yl)-N-(1,3-thiazol-2-yl)propanamide
Compound characteristics
| Compound ID: | J021-1349 |
| Compound Name: | 3-(3-{[(5-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]methyl}-1,2,4-oxadiazol-5-yl)-N-(1,3-thiazol-2-yl)propanamide |
| Molecular Weight: | 413.48 |
| Molecular Formula: | C17 H15 N7 O2 S2 |
| Smiles: | C(Cc1nc(CSc2nnc(c3ccccc3)[nH]2)no1)C(Nc1nccs1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.1533 |
| logD: | 0.9526 |
| logSw: | -2.7041 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 98.435 |
| InChI Key: | BDNCZJABXBUCDV-UHFFFAOYSA-N |