methyl 4-chloro-2-[(1-ethyl-6-methyl-3,4-dihydropyrrolo[1,2-a]pyrazine-2(1H)-carbonyl)amino]benzoate
Chemical Structure Depiction of
methyl 4-chloro-2-[(1-ethyl-6-methyl-3,4-dihydropyrrolo[1,2-a]pyrazine-2(1H)-carbonyl)amino]benzoate
methyl 4-chloro-2-[(1-ethyl-6-methyl-3,4-dihydropyrrolo[1,2-a]pyrazine-2(1H)-carbonyl)amino]benzoate
Compound characteristics
| Compound ID: | E002-1118 |
| Compound Name: | methyl 4-chloro-2-[(1-ethyl-6-methyl-3,4-dihydropyrrolo[1,2-a]pyrazine-2(1H)-carbonyl)amino]benzoate |
| Molecular Weight: | 375.85 |
| Molecular Formula: | C19 H22 Cl N3 O3 |
| Smiles: | CCC1c2ccc(C)n2CCN1C(Nc1cc(ccc1C(=O)OC)[Cl])=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.1769 |
| logD: | 4.1356 |
| logSw: | -4.4389 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 46.835 |
| InChI Key: | YVMCQZFGYQZXTG-INIZCTEOSA-N |