N-(3-fluorophenyl)-5-{[(2-{[(5-methylfuran-2-yl)methyl]amino}-2-oxoethyl)sulfanyl]methyl}-1,3,4-thiadiazole-2-carboxamide
Chemical Structure Depiction of
N-(3-fluorophenyl)-5-{[(2-{[(5-methylfuran-2-yl)methyl]amino}-2-oxoethyl)sulfanyl]methyl}-1,3,4-thiadiazole-2-carboxamide
N-(3-fluorophenyl)-5-{[(2-{[(5-methylfuran-2-yl)methyl]amino}-2-oxoethyl)sulfanyl]methyl}-1,3,4-thiadiazole-2-carboxamide
Compound characteristics
| Compound ID: | F499-0979 |
| Compound Name: | N-(3-fluorophenyl)-5-{[(2-{[(5-methylfuran-2-yl)methyl]amino}-2-oxoethyl)sulfanyl]methyl}-1,3,4-thiadiazole-2-carboxamide |
| Molecular Weight: | 420.48 |
| Molecular Formula: | C18 H17 F N4 O3 S2 |
| Smiles: | Cc1ccc(CNC(CSCc2nnc(C(Nc3cccc(c3)F)=O)s2)=O)o1 |
| Stereo: | ACHIRAL |
| logP: | 3.4445 |
| logD: | 3.4413 |
| logSw: | -3.7589 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 78.792 |
| InChI Key: | PYKQHYLRFODWHO-UHFFFAOYSA-N |