2-[(2,4-dimethylphenyl)methyl]-8-(morpholine-4-sulfonyl)[1,2,4]triazolo[4,3-a]pyridin-3(2H)-one
Chemical Structure Depiction of
2-[(2,4-dimethylphenyl)methyl]-8-(morpholine-4-sulfonyl)[1,2,4]triazolo[4,3-a]pyridin-3(2H)-one
2-[(2,4-dimethylphenyl)methyl]-8-(morpholine-4-sulfonyl)[1,2,4]triazolo[4,3-a]pyridin-3(2H)-one
Compound characteristics
| Compound ID: | M113-0678 |
| Compound Name: | 2-[(2,4-dimethylphenyl)methyl]-8-(morpholine-4-sulfonyl)[1,2,4]triazolo[4,3-a]pyridin-3(2H)-one |
| Molecular Weight: | 402.47 |
| Molecular Formula: | C19 H22 N4 O4 S |
| Smiles: | Cc1ccc(CN2C(N3C=CC=C(C3=N2)S(N2CCOCC2)(=O)=O)=O)c(C)c1 |
| Stereo: | ACHIRAL |
| logP: | 2.2931 |
| logD: | 2.2931 |
| logSw: | -2.6303 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 70.921 |
| InChI Key: | OICLBBGBRPAKIN-UHFFFAOYSA-N |