3-{4-[(2,3,4-trimethoxyphenyl)methyl]piperazine-1-carbonyl}-7,8,9,10-tetrahydro-5H-pyrido[1,2-a]quinoxalin-6(6aH)-one
Chemical Structure Depiction of
3-{4-[(2,3,4-trimethoxyphenyl)methyl]piperazine-1-carbonyl}-7,8,9,10-tetrahydro-5H-pyrido[1,2-a]quinoxalin-6(6aH)-one
3-{4-[(2,3,4-trimethoxyphenyl)methyl]piperazine-1-carbonyl}-7,8,9,10-tetrahydro-5H-pyrido[1,2-a]quinoxalin-6(6aH)-one
Compound characteristics
| Compound ID: | G587-0042 |
| Compound Name: | 3-{4-[(2,3,4-trimethoxyphenyl)methyl]piperazine-1-carbonyl}-7,8,9,10-tetrahydro-5H-pyrido[1,2-a]quinoxalin-6(6aH)-one |
| Molecular Weight: | 494.59 |
| Molecular Formula: | C27 H34 N4 O5 |
| Smiles: | COc1ccc(CN2CCN(CC2)C(c2ccc3c(c2)NC(C2CCCCN23)=O)=O)c(c1OC)OC |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.3582 |
| logD: | 2.1576 |
| logSw: | -3.1029 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 70.82 |
| InChI Key: | VPCYXCCSEIJINC-QFIPXVFZSA-N |