6-(4-chlorophenyl)-N-{[4-(methylsulfanyl)phenyl]methyl}-6,7-dihydro-4H-pyrazolo[5,1-c][1,4]oxazine-2-carboxamide
Chemical Structure Depiction of
6-(4-chlorophenyl)-N-{[4-(methylsulfanyl)phenyl]methyl}-6,7-dihydro-4H-pyrazolo[5,1-c][1,4]oxazine-2-carboxamide
6-(4-chlorophenyl)-N-{[4-(methylsulfanyl)phenyl]methyl}-6,7-dihydro-4H-pyrazolo[5,1-c][1,4]oxazine-2-carboxamide
Compound characteristics
| Compound ID: | S368-0869 |
| Compound Name: | 6-(4-chlorophenyl)-N-{[4-(methylsulfanyl)phenyl]methyl}-6,7-dihydro-4H-pyrazolo[5,1-c][1,4]oxazine-2-carboxamide |
| Molecular Weight: | 413.92 |
| Molecular Formula: | C21 H20 Cl N3 O2 S |
| Smiles: | CSc1ccc(CNC(c2cc3COC(Cn3n2)c2ccc(cc2)[Cl])=O)cc1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.0058 |
| logD: | 4.0058 |
| logSw: | -4.7021 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 46.395 |
| InChI Key: | KDSWDMKUUIFWCY-FQEVSTJZSA-N |