S-[3-(8-methyl-1,2,3a,4,5,6-hexahydro-3H-pyrazino[3,2,1-jk]carbazol-3-yl)-3-oxopropyl] ethanethioate
Chemical Structure Depiction of
S-[3-(8-methyl-1,2,3a,4,5,6-hexahydro-3H-pyrazino[3,2,1-jk]carbazol-3-yl)-3-oxopropyl] ethanethioate
S-[3-(8-methyl-1,2,3a,4,5,6-hexahydro-3H-pyrazino[3,2,1-jk]carbazol-3-yl)-3-oxopropyl] ethanethioate
Compound characteristics
| Compound ID: | 3807-3079 |
| Compound Name: | S-[3-(8-methyl-1,2,3a,4,5,6-hexahydro-3H-pyrazino[3,2,1-jk]carbazol-3-yl)-3-oxopropyl] ethanethioate |
| Molecular Weight: | 356.49 |
| Molecular Formula: | C20 H24 N2 O2 S |
| Smiles: | CC(=O)SCCC(N1CCn2c3C1CCCc3c1cc(C)ccc12)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.2917 |
| logD: | 4.2917 |
| logSw: | -4.3014 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 29.4373 |
| InChI Key: | GCIGALMERIGXND-SFHVURJKSA-N |