N-[(4-butoxyphenyl)methyl]-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-[(4-butoxyphenyl)methyl]-4-(3-methyl-5-oxo-1-phenyl-5,6-dihydropyrazolo[3,4-b][1,4]thiazin-4(1H)-yl)butanamide
N-[(4-butoxyphenyl)methyl]-4-(3-methyl-5-oxo-1-phenyl-5,6-dihydropyrazolo[3,4-b][1,4]thiazin-4(1H)-yl)butanamide
Compound characteristics
| Compound ID: | G279-1226 |
| Compound Name: | N-[(4-butoxyphenyl)methyl]-4-(3-methyl-5-oxo-1-phenyl-5,6-dihydropyrazolo[3,4-b][1,4]thiazin-4(1H)-yl)butanamide |
| Molecular Weight: | 492.64 |
| Molecular Formula: | C27 H32 N4 O3 S |
| Smiles: | CCCCOc1ccc(CNC(CCCN2C(CSc3c2c(C)nn3c2ccccc2)=O)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 3.8795 |
| logD: | 3.8795 |
| logSw: | -3.8186 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 61.436 |
| InChI Key: | JLJWYGXIOANJBR-UHFFFAOYSA-N |