3-[4-methoxy-3-(pyrrolidine-1-sulfonyl)phenyl]-6-methyl[1,2,4]triazolo[3,4-a]phthalazine
Chemical Structure Depiction of
3-[4-methoxy-3-(pyrrolidine-1-sulfonyl)phenyl]-6-methyl[1,2,4]triazolo[3,4-a]phthalazine
3-[4-methoxy-3-(pyrrolidine-1-sulfonyl)phenyl]-6-methyl[1,2,4]triazolo[3,4-a]phthalazine
Compound characteristics
| Compound ID: | 6725-3956 |
| Compound Name: | 3-[4-methoxy-3-(pyrrolidine-1-sulfonyl)phenyl]-6-methyl[1,2,4]triazolo[3,4-a]phthalazine |
| Molecular Weight: | 423.49 |
| Molecular Formula: | C21 H21 N5 O3 S |
| Smiles: | Cc1c2ccccc2c2nnc(c3ccc(c(c3)S(N3CCCC3)(=O)=O)OC)n2n1 |
| Stereo: | ACHIRAL |
| logP: | 2.8952 |
| logD: | 2.8952 |
| logSw: | -3.3224 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 72.956 |
| InChI Key: | LJBGFWCSYLYJPG-UHFFFAOYSA-N |