methyl 3-(2-{[8-phenyl-7-(prop-2-enoyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyrazine-2-carbonyl]amino}ethyl)benzoate
Chemical Structure Depiction of
methyl 3-(2-{[8-phenyl-7-(prop-2-enoyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyrazine-2-carbonyl]amino}ethyl)benzoate
methyl 3-(2-{[8-phenyl-7-(prop-2-enoyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyrazine-2-carbonyl]amino}ethyl)benzoate
Compound characteristics
| Compound ID: | T003-0001 |
| Compound Name: | methyl 3-(2-{[8-phenyl-7-(prop-2-enoyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyrazine-2-carbonyl]amino}ethyl)benzoate |
| Molecular Weight: | 458.52 |
| Molecular Formula: | C26 H26 N4 O4 |
| Smiles: | COC(c1cccc(CCNC(c2cn3CCN(C(c4ccccc4)c3n2)C(C=C)=O)=O)c1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.8846 |
| logD: | 2.8846 |
| logSw: | -3.2835 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 73.006 |
| InChI Key: | GNCSWVIKLSMCSB-HSZRJFAPSA-N |