N-[(2H-1,3-benzodioxol-5-yl)methyl]-4-(3-methyl-1-phenyl-5,6-dihydropyrazolo[3,4-b][1,4]thiazin-4(1H)-yl)-4-oxobutanamide
Chemical Structure Depiction of
N-[(2H-1,3-benzodioxol-5-yl)methyl]-4-(3-methyl-1-phenyl-5,6-dihydropyrazolo[3,4-b][1,4]thiazin-4(1H)-yl)-4-oxobutanamide
N-[(2H-1,3-benzodioxol-5-yl)methyl]-4-(3-methyl-1-phenyl-5,6-dihydropyrazolo[3,4-b][1,4]thiazin-4(1H)-yl)-4-oxobutanamide
Compound characteristics
| Compound ID: | G390-0092 |
| Compound Name: | N-[(2H-1,3-benzodioxol-5-yl)methyl]-4-(3-methyl-1-phenyl-5,6-dihydropyrazolo[3,4-b][1,4]thiazin-4(1H)-yl)-4-oxobutanamide |
| Molecular Weight: | 464.54 |
| Molecular Formula: | C24 H24 N4 O4 S |
| Smiles: | Cc1c2c(n(c3ccccc3)n1)SCCN2C(CCC(NCc1ccc2c(c1)OCO2)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.5316 |
| logD: | 2.5316 |
| logSw: | -2.9298 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 70.56 |
| InChI Key: | WAZOUQVNTSVFOL-UHFFFAOYSA-N |