5-(3-chloro-4-methylphenyl)-N-{[4-([1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)phenyl]methyl}furan-2-carboxamide
Chemical Structure Depiction of
5-(3-chloro-4-methylphenyl)-N-{[4-([1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)phenyl]methyl}furan-2-carboxamide
5-(3-chloro-4-methylphenyl)-N-{[4-([1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)phenyl]methyl}furan-2-carboxamide
Compound characteristics
| Compound ID: | J011-0113 |
| Compound Name: | 5-(3-chloro-4-methylphenyl)-N-{[4-([1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)phenyl]methyl}furan-2-carboxamide |
| Molecular Weight: | 449.92 |
| Molecular Formula: | C22 H16 Cl N5 O2 S |
| Smiles: | Cc1ccc(cc1[Cl])c1ccc(C(NCc2ccc(cc2)c2nn3cnnc3s2)=O)o1 |
| Stereo: | ACHIRAL |
| logP: | 4.3989 |
| logD: | 4.3989 |
| logSw: | -4.5629 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 67.457 |
| InChI Key: | KGGISEVZFOBHCU-UHFFFAOYSA-N |