N-{[1-(2,4-dimethyl-1,3-thiazole-5-carbonyl)-4'H,7'H-spiro[pyrrolidine-3,6'-[1,2,3]triazolo[5,1-c][1,4]oxazin]-3'-yl]methyl}oxane-4-carboxamide
Chemical Structure Depiction of
N-{[1-(2,4-dimethyl-1,3-thiazole-5-carbonyl)-4'H,7'H-spiro[pyrrolidine-3,6'-[1,2,3]triazolo[5,1-c][1,4]oxazin]-3'-yl]methyl}oxane-4-carboxamide
N-{[1-(2,4-dimethyl-1,3-thiazole-5-carbonyl)-4'H,7'H-spiro[pyrrolidine-3,6'-[1,2,3]triazolo[5,1-c][1,4]oxazin]-3'-yl]methyl}oxane-4-carboxamide
Compound characteristics
| Compound ID: | SD07-0416 |
| Compound Name: | N-{[1-(2,4-dimethyl-1,3-thiazole-5-carbonyl)-4'H,7'H-spiro[pyrrolidine-3,6'-[1,2,3]triazolo[5,1-c][1,4]oxazin]-3'-yl]methyl}oxane-4-carboxamide |
| Molecular Weight: | 460.55 |
| Molecular Formula: | C21 H28 N6 O4 S |
| Smiles: | Cc1c(C(N2CCC3(C2)Cn2c(CO3)c(CNC(C3CCOCC3)=O)nn2)=O)sc(C)n1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 0.411 |
| logD: | 0.411 |
| logSw: | -1.7491 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 93.933 |
| InChI Key: | HNMVSYKUKJVTDQ-NRFANRHFSA-N |