4-(1,3-benzothiazol-2-yl)-1-[3'-(methoxymethyl)-4'H,7'H-spiro[piperidine-4,6'-[1,2,3]triazolo[5,1-c][1,4]oxazin]-1-yl]butan-1-one
Chemical Structure Depiction of
4-(1,3-benzothiazol-2-yl)-1-[3'-(methoxymethyl)-4'H,7'H-spiro[piperidine-4,6'-[1,2,3]triazolo[5,1-c][1,4]oxazin]-1-yl]butan-1-one
4-(1,3-benzothiazol-2-yl)-1-[3'-(methoxymethyl)-4'H,7'H-spiro[piperidine-4,6'-[1,2,3]triazolo[5,1-c][1,4]oxazin]-1-yl]butan-1-one
Compound characteristics
| Compound ID: | SC40-0179 |
| Compound Name: | 4-(1,3-benzothiazol-2-yl)-1-[3'-(methoxymethyl)-4'H,7'H-spiro[piperidine-4,6'-[1,2,3]triazolo[5,1-c][1,4]oxazin]-1-yl]butan-1-one |
| Molecular Weight: | 441.55 |
| Molecular Formula: | C22 H27 N5 O3 S |
| Smiles: | COCc1c2COC3(CCN(CC3)C(CCCc3nc4ccccc4s3)=O)Cn2nn1 |
| Stereo: | ACHIRAL |
| logP: | 1.7998 |
| logD: | 1.7998 |
| logSw: | -2.2464 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 68.843 |
| InChI Key: | MAYWDHQCELAIPI-UHFFFAOYSA-N |