N-{[1-(cyclopentylacetyl)-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-(cyclopentylacetyl)-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-(cyclopentylacetyl)-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: | SD07-0804 |
| Compound Name: | N-{[1-(cyclopentylacetyl)-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: | 425.55 |
| Molecular Formula: | C19 H31 N5 O4 S |
| Smiles: | CCCS(NCc1c2COC3(CCN(C3)C(CC3CCCC3)=O)Cn2nn1)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.0667 |
| logD: | 1.0587 |
| logSw: | -1.9392 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 94.718 |
| InChI Key: | AGWOPJQGTAYCQC-IBGZPJMESA-N |