N-{[1-(cyclohexylacetyl)-4'H,7'H-spiro[pyrrolidine-3,6'-[1,2,3]triazolo[5,1-c][1,4]oxazin]-3'-yl]methyl}propane-2-sulfonamide
Chemical Structure Depiction of
N-{[1-(cyclohexylacetyl)-4'H,7'H-spiro[pyrrolidine-3,6'-[1,2,3]triazolo[5,1-c][1,4]oxazin]-3'-yl]methyl}propane-2-sulfonamide
N-{[1-(cyclohexylacetyl)-4'H,7'H-spiro[pyrrolidine-3,6'-[1,2,3]triazolo[5,1-c][1,4]oxazin]-3'-yl]methyl}propane-2-sulfonamide
Compound characteristics
| Compound ID: | SD07-0784 |
| Compound Name: | N-{[1-(cyclohexylacetyl)-4'H,7'H-spiro[pyrrolidine-3,6'-[1,2,3]triazolo[5,1-c][1,4]oxazin]-3'-yl]methyl}propane-2-sulfonamide |
| Molecular Weight: | 439.58 |
| Molecular Formula: | C20 H33 N5 O4 S |
| Smiles: | CC(C)S(NCc1c2COC3(CCN(C3)C(CC3CCCCC3)=O)Cn2nn1)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.8835 |
| logD: | 1.8729 |
| logSw: | -2.3853 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 92.725 |
| InChI Key: | WVQXMJKCCZQXPK-FQEVSTJZSA-N |