N-[1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]-4-(3-methyl-5-oxo-1-phenyl-5,6-dihydropyrazolo[3,4-b][1,4]thiazin-4(1H)-yl)butanamide
Chemical Structure Depiction of
N-[1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]-4-(3-methyl-5-oxo-1-phenyl-5,6-dihydropyrazolo[3,4-b][1,4]thiazin-4(1H)-yl)butanamide
N-[1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]-4-(3-methyl-5-oxo-1-phenyl-5,6-dihydropyrazolo[3,4-b][1,4]thiazin-4(1H)-yl)butanamide
Compound characteristics
| Compound ID: | G279-1183 |
| Compound Name: | N-[1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]-4-(3-methyl-5-oxo-1-phenyl-5,6-dihydropyrazolo[3,4-b][1,4]thiazin-4(1H)-yl)butanamide |
| Molecular Weight: | 492.6 |
| Molecular Formula: | C26 H28 N4 O4 S |
| Smiles: | CC(c1ccc2c(c1)OCCO2)NC(CCCN1C(CSc2c1c(C)nn2c1ccccc1)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.0719 |
| logD: | 2.0719 |
| logSw: | -2.7386 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 69.004 |
| InChI Key: | LLRSQMFWRXCLJD-KRWDZBQOSA-N |