1-ethyl-N-[(1-{[1-(propan-2-yl)-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]-1H-pyrazole-5-carboxamide
Chemical Structure Depiction of
1-ethyl-N-[(1-{[1-(propan-2-yl)-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]-1H-pyrazole-5-carboxamide
1-ethyl-N-[(1-{[1-(propan-2-yl)-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]-1H-pyrazole-5-carboxamide
Compound characteristics
| Compound ID: | SD07-0914 |
| Compound Name: | 1-ethyl-N-[(1-{[1-(propan-2-yl)-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]-1H-pyrazole-5-carboxamide |
| Molecular Weight: | 453.55 |
| Molecular Formula: | C22 H31 N9 O2 |
| Smiles: | CCn1c(ccn1)C(NCc1c2COC3(CCN(Cc4cnn(c4)C(C)C)C3)Cn2nn1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 0.104 |
| logD: | -5.744 |
| logSw: | -1.6822 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 90.578 |
| InChI Key: | ZOJRZMPUUVIGLP-QFIPXVFZSA-N |