N-{[1-(cyclopentanecarbonyl)-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-(cyclopentanecarbonyl)-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-(cyclopentanecarbonyl)-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: | SD07-0799 |
| Compound Name: | N-{[1-(cyclopentanecarbonyl)-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: | 411.52 |
| Molecular Formula: | C18 H29 N5 O4 S |
| Smiles: | CCCS(NCc1c2COC3(CCN(C3)C(C3CCCC3)=O)Cn2nn1)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 0.8915 |
| logD: | 0.8835 |
| logSw: | -1.8932 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 95.245 |
| InChI Key: | IKHMPPPYKQLSOM-SFHVURJKSA-N |