N-(4-chlorophenyl)-4-(3-methyl-1-phenyl-5,6-dihydropyrazolo[3,4-b][1,4]thiazin-4(1H)-yl)-4-oxobutanamide
Chemical Structure Depiction of
N-(4-chlorophenyl)-4-(3-methyl-1-phenyl-5,6-dihydropyrazolo[3,4-b][1,4]thiazin-4(1H)-yl)-4-oxobutanamide
N-(4-chlorophenyl)-4-(3-methyl-1-phenyl-5,6-dihydropyrazolo[3,4-b][1,4]thiazin-4(1H)-yl)-4-oxobutanamide
Compound characteristics
| Compound ID: | G390-0063 |
| Compound Name: | N-(4-chlorophenyl)-4-(3-methyl-1-phenyl-5,6-dihydropyrazolo[3,4-b][1,4]thiazin-4(1H)-yl)-4-oxobutanamide |
| Molecular Weight: | 440.95 |
| Molecular Formula: | C22 H21 Cl N4 O2 S |
| Smiles: | Cc1c2c(n(c3ccccc3)n1)SCCN2C(CCC(Nc1ccc(cc1)[Cl])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.513 |
| logD: | 3.5128 |
| logSw: | -4.0168 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 52.122 |
| InChI Key: | LOXOUYPKGXKXBZ-UHFFFAOYSA-N |