2-[4-(4-methoxyphenyl)-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl]-1-[3-methyl-4-(4-nitrobenzoyl)piperazin-1-yl]ethan-1-one
Chemical Structure Depiction of
2-[4-(4-methoxyphenyl)-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl]-1-[3-methyl-4-(4-nitrobenzoyl)piperazin-1-yl]ethan-1-one
2-[4-(4-methoxyphenyl)-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl]-1-[3-methyl-4-(4-nitrobenzoyl)piperazin-1-yl]ethan-1-one
Compound characteristics
| Compound ID: | V007-6203 |
| Compound Name: | 2-[4-(4-methoxyphenyl)-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl]-1-[3-methyl-4-(4-nitrobenzoyl)piperazin-1-yl]ethan-1-one |
| Molecular Weight: | 534.63 |
| Molecular Formula: | C28 H30 N4 O5 S |
| Salt: | not_available |
| Smiles: | CC1CN(CCN1C(c1ccc(cc1)[N+]([O-])=O)=O)C(CN1CCc2c(ccs2)C1c1ccc(cc1)OC)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.048 |
| logD: | 4.0254 |
| logSw: | -4.0858 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 77.122 |
| InChI Key: | BHFRRHCKJOHMIM-UHFFFAOYSA-N |