N-({1-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-4'H,7'H-spiro[pyrrolidine-3,6'-[1,2,3]triazolo[5,1-c][1,4]oxazin]-3'-yl}methyl)-1-ethyl-1H-pyrazole-5-carboxamide
Chemical Structure Depiction of
N-({1-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-4'H,7'H-spiro[pyrrolidine-3,6'-[1,2,3]triazolo[5,1-c][1,4]oxazin]-3'-yl}methyl)-1-ethyl-1H-pyrazole-5-carboxamide
N-({1-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-4'H,7'H-spiro[pyrrolidine-3,6'-[1,2,3]triazolo[5,1-c][1,4]oxazin]-3'-yl}methyl)-1-ethyl-1H-pyrazole-5-carboxamide
Compound characteristics
| Compound ID: | SD07-0941 |
| Compound Name: | N-({1-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-4'H,7'H-spiro[pyrrolidine-3,6'-[1,2,3]triazolo[5,1-c][1,4]oxazin]-3'-yl}methyl)-1-ethyl-1H-pyrazole-5-carboxamide |
| Molecular Weight: | 440.5 |
| Molecular Formula: | C21 H28 N8 O3 |
| Smiles: | CCn1c(ccn1)C(NCc1c2COC3(CCN(Cc4c(C)noc4C)C3)Cn2nn1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 0.1317 |
| logD: | -1.9297 |
| logSw: | -1.7846 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 97.655 |
| InChI Key: | OBFLMTQULVUPMM-NRFANRHFSA-N |