5-(hydroxymethyl)-8-methyl-3-{5-[4-(propan-2-yl)anilino]-1,3,4-thiadiazol-2-yl}-2H-pyrano[2,3-c]pyridin-2-one
Chemical Structure Depiction of
5-(hydroxymethyl)-8-methyl-3-{5-[4-(propan-2-yl)anilino]-1,3,4-thiadiazol-2-yl}-2H-pyrano[2,3-c]pyridin-2-one
5-(hydroxymethyl)-8-methyl-3-{5-[4-(propan-2-yl)anilino]-1,3,4-thiadiazol-2-yl}-2H-pyrano[2,3-c]pyridin-2-one
Compound characteristics
| Compound ID: | K227-0556 |
| Compound Name: | 5-(hydroxymethyl)-8-methyl-3-{5-[4-(propan-2-yl)anilino]-1,3,4-thiadiazol-2-yl}-2H-pyrano[2,3-c]pyridin-2-one |
| Molecular Weight: | 408.48 |
| Molecular Formula: | C21 H20 N4 O3 S |
| Smiles: | CC(C)c1ccc(cc1)Nc1nnc(C2=Cc3c(CO)cnc(C)c3OC2=O)s1 |
| Stereo: | ACHIRAL |
| logP: | 4.2794 |
| logD: | 4.2794 |
| logSw: | -4.148 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 79.86 |
| InChI Key: | FHCVHASWEPXRLK-UHFFFAOYSA-N |