N-{[1-(2-methylpropyl)-4'H,7'H-spiro[pyrrolidine-3,6'-[1,2,3]triazolo[5,1-c][1,4]oxazin]-3'-yl]methyl}propane-1-sulfonamide
Chemical Structure Depiction of
N-{[1-(2-methylpropyl)-4'H,7'H-spiro[pyrrolidine-3,6'-[1,2,3]triazolo[5,1-c][1,4]oxazin]-3'-yl]methyl}propane-1-sulfonamide
N-{[1-(2-methylpropyl)-4'H,7'H-spiro[pyrrolidine-3,6'-[1,2,3]triazolo[5,1-c][1,4]oxazin]-3'-yl]methyl}propane-1-sulfonamide
Compound characteristics
| Compound ID: | SD07-0829 |
| Compound Name: | N-{[1-(2-methylpropyl)-4'H,7'H-spiro[pyrrolidine-3,6'-[1,2,3]triazolo[5,1-c][1,4]oxazin]-3'-yl]methyl}propane-1-sulfonamide |
| Molecular Weight: | 371.5 |
| Molecular Formula: | C16 H29 N5 O3 S |
| Smiles: | CCCS(NCc1c2COC3(CCN(CC(C)C)C3)Cn2nn1)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 0.9855 |
| logD: | -0.689 |
| logSw: | -1.8301 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 82.043 |
| InChI Key: | KKFKPZTWXIBKQZ-INIZCTEOSA-N |