N-({1-[(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)methyl]-4'H,7'H-spiro[pyrrolidine-3,6'-[1,2,3]triazolo[5,1-c][1,4]oxazin]-3'-yl}methyl)-3-methylbenzamide
Chemical Structure Depiction of
N-({1-[(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)methyl]-4'H,7'H-spiro[pyrrolidine-3,6'-[1,2,3]triazolo[5,1-c][1,4]oxazin]-3'-yl}methyl)-3-methylbenzamide
N-({1-[(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)methyl]-4'H,7'H-spiro[pyrrolidine-3,6'-[1,2,3]triazolo[5,1-c][1,4]oxazin]-3'-yl}methyl)-3-methylbenzamide
Compound characteristics
| Compound ID: | SD07-0326 |
| Compound Name: | N-({1-[(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)methyl]-4'H,7'H-spiro[pyrrolidine-3,6'-[1,2,3]triazolo[5,1-c][1,4]oxazin]-3'-yl}methyl)-3-methylbenzamide |
| Molecular Weight: | 463.58 |
| Molecular Formula: | C25 H33 N7 O2 |
| Smiles: | CCn1c(C)c(CN2CCC3(C2)Cn2c(CO3)c(CNC(c3cccc(C)c3)=O)nn2)c(C)n1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.6047 |
| logD: | -3.0945 |
| logSw: | -2.2557 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 76.806 |
| InChI Key: | KEEWDXBYZTZKIS-VWLOTQADSA-N |