3-(1,3-benzothiazol-2-yl)-N-{[2-(2-methylpropyl)-1-oxo-1,2,3,4-tetrahydropyrrolo[1,2-a]pyrazin-3-yl]methyl}propanamide
Chemical Structure Depiction of
3-(1,3-benzothiazol-2-yl)-N-{[2-(2-methylpropyl)-1-oxo-1,2,3,4-tetrahydropyrrolo[1,2-a]pyrazin-3-yl]methyl}propanamide
3-(1,3-benzothiazol-2-yl)-N-{[2-(2-methylpropyl)-1-oxo-1,2,3,4-tetrahydropyrrolo[1,2-a]pyrazin-3-yl]methyl}propanamide
Compound characteristics
| Compound ID: | S582-0195 |
| Compound Name: | 3-(1,3-benzothiazol-2-yl)-N-{[2-(2-methylpropyl)-1-oxo-1,2,3,4-tetrahydropyrrolo[1,2-a]pyrazin-3-yl]methyl}propanamide |
| Molecular Weight: | 410.54 |
| Molecular Formula: | C22 H26 N4 O2 S |
| Smiles: | CC(C)CN1C(CNC(CCc2nc3ccccc3s2)=O)Cn2cccc2C1=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.4002 |
| logD: | 3.4002 |
| logSw: | -3.7669 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 53.172 |
| InChI Key: | CKCMNHYWKGILAX-INIZCTEOSA-N |