N-[(2-chlorophenyl)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-[(2-chlorophenyl)methyl]-4-(3-methyl-1-phenyl-5,6-dihydropyrazolo[3,4-b][1,4]thiazin-4(1H)-yl)-4-oxobutanamide
N-[(2-chlorophenyl)methyl]-4-(3-methyl-1-phenyl-5,6-dihydropyrazolo[3,4-b][1,4]thiazin-4(1H)-yl)-4-oxobutanamide
Compound characteristics
| Compound ID: | G390-0064 |
| Compound Name: | N-[(2-chlorophenyl)methyl]-4-(3-methyl-1-phenyl-5,6-dihydropyrazolo[3,4-b][1,4]thiazin-4(1H)-yl)-4-oxobutanamide |
| Molecular Weight: | 454.98 |
| Molecular Formula: | C23 H23 Cl N4 O2 S |
| Smiles: | Cc1c2c(n(c3ccccc3)n1)SCCN2C(CCC(NCc1ccccc1[Cl])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.4005 |
| logD: | 3.4005 |
| logSw: | -3.6496 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 53.444 |
| InChI Key: | VPCVTPBXKHAVMI-UHFFFAOYSA-N |