5-[2-(azepan-1-yl)-2-oxoethyl]-3-(pyrrolidine-1-sulfonyl)-7,8,9,10-tetrahydro-5H-pyrido[1,2-a]quinoxalin-6(6aH)-one
Chemical Structure Depiction of
5-[2-(azepan-1-yl)-2-oxoethyl]-3-(pyrrolidine-1-sulfonyl)-7,8,9,10-tetrahydro-5H-pyrido[1,2-a]quinoxalin-6(6aH)-one
5-[2-(azepan-1-yl)-2-oxoethyl]-3-(pyrrolidine-1-sulfonyl)-7,8,9,10-tetrahydro-5H-pyrido[1,2-a]quinoxalin-6(6aH)-one
Compound characteristics
| Compound ID: | G672-0249 |
| Compound Name: | 5-[2-(azepan-1-yl)-2-oxoethyl]-3-(pyrrolidine-1-sulfonyl)-7,8,9,10-tetrahydro-5H-pyrido[1,2-a]quinoxalin-6(6aH)-one |
| Molecular Weight: | 474.62 |
| Molecular Formula: | C24 H34 N4 O4 S |
| Smiles: | C1CCCN(CC1)C(CN1C(C2CCCCN2c2ccc(cc12)S(N1CCCC1)(=O)=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.4746 |
| logD: | 2.4746 |
| logSw: | -2.8082 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 66.592 |
| InChI Key: | CFPPQZZBZXWBSP-OAQYLSRUSA-N |