3-(1,3-benzothiazol-2-yl)-N-({1-oxo-2-[(pyridin-3-yl)methyl]-1,2,3,4-tetrahydropyrrolo[1,2-a]pyrazin-3-yl}methyl)propanamide
Chemical Structure Depiction of
3-(1,3-benzothiazol-2-yl)-N-({1-oxo-2-[(pyridin-3-yl)methyl]-1,2,3,4-tetrahydropyrrolo[1,2-a]pyrazin-3-yl}methyl)propanamide
3-(1,3-benzothiazol-2-yl)-N-({1-oxo-2-[(pyridin-3-yl)methyl]-1,2,3,4-tetrahydropyrrolo[1,2-a]pyrazin-3-yl}methyl)propanamide
Compound characteristics
| Compound ID: | S582-0652 |
| Compound Name: | 3-(1,3-benzothiazol-2-yl)-N-({1-oxo-2-[(pyridin-3-yl)methyl]-1,2,3,4-tetrahydropyrrolo[1,2-a]pyrazin-3-yl}methyl)propanamide |
| Molecular Weight: | 445.54 |
| Molecular Formula: | C24 H23 N5 O2 S |
| Smiles: | C(Cc1nc2ccccc2s1)C(NCC1Cn2cccc2C(N1Cc1cccnc1)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.1932 |
| logD: | 2.1932 |
| logSw: | -2.1757 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 62.418 |
| InChI Key: | JAXONAAYXPJAKY-SFHVURJKSA-N |