5-ethyl-8-[(prop-2-en-1-yl)sulfanyl]-1,2,3,4-tetrahydropyrimido[4',5':4,5]thieno[2,3-c]isoquinoline
Chemical Structure Depiction of
5-ethyl-8-[(prop-2-en-1-yl)sulfanyl]-1,2,3,4-tetrahydropyrimido[4',5':4,5]thieno[2,3-c]isoquinoline
5-ethyl-8-[(prop-2-en-1-yl)sulfanyl]-1,2,3,4-tetrahydropyrimido[4',5':4,5]thieno[2,3-c]isoquinoline
Compound characteristics
| Compound ID: | 5921-0233 |
| Compound Name: | 5-ethyl-8-[(prop-2-en-1-yl)sulfanyl]-1,2,3,4-tetrahydropyrimido[4',5':4,5]thieno[2,3-c]isoquinoline |
| Molecular Weight: | 341.5 |
| Molecular Formula: | C18 H19 N3 S2 |
| Smiles: | CCc1c2CCCCc2c2c3c(c(ncn3)SCC=C)sc2n1 |
| Stereo: | ACHIRAL |
| logP: | 5.6147 |
| logD: | 5.6146 |
| logSw: | -5.6747 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 31.572 |
| InChI Key: | DMRQZFKOHSOMPL-UHFFFAOYSA-N |