N-[(2-benzyl-1,2,3,4-tetrahydropyrrolo[1,2-a]pyrazin-3-yl)methyl]-5-bromopyridine-3-carboxamide
Chemical Structure Depiction of
N-[(2-benzyl-1,2,3,4-tetrahydropyrrolo[1,2-a]pyrazin-3-yl)methyl]-5-bromopyridine-3-carboxamide
N-[(2-benzyl-1,2,3,4-tetrahydropyrrolo[1,2-a]pyrazin-3-yl)methyl]-5-bromopyridine-3-carboxamide
Compound characteristics
| Compound ID: | S590-0611 |
| Compound Name: | N-[(2-benzyl-1,2,3,4-tetrahydropyrrolo[1,2-a]pyrazin-3-yl)methyl]-5-bromopyridine-3-carboxamide |
| Molecular Weight: | 425.33 |
| Molecular Formula: | C21 H21 Br N4 O |
| Smiles: | C(C1Cn2cccc2CN1Cc1ccccc1)NC(c1cc(cnc1)[Br])=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.9734 |
| logD: | 2.9719 |
| logSw: | -3.1346 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 40.242 |
| InChI Key: | XQKQJJAINRNUJC-FQEVSTJZSA-N |