2-[4-(2-methylphenyl)-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl]-1-[4-(3-nitrobenzoyl)piperazin-1-yl]propan-1-one
Chemical Structure Depiction of
2-[4-(2-methylphenyl)-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl]-1-[4-(3-nitrobenzoyl)piperazin-1-yl]propan-1-one
2-[4-(2-methylphenyl)-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl]-1-[4-(3-nitrobenzoyl)piperazin-1-yl]propan-1-one
Compound characteristics
| Compound ID: | V002-8029 |
| Compound Name: | 2-[4-(2-methylphenyl)-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl]-1-[4-(3-nitrobenzoyl)piperazin-1-yl]propan-1-one |
| Molecular Weight: | 518.63 |
| Molecular Formula: | C28 H30 N4 O4 S |
| Salt: | not_available |
| Smiles: | CC(C(N1CCN(CC1)C(c1cccc(c1)[N+]([O-])=O)=O)=O)N1CCc2c(ccs2)C1c1ccccc1C |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.4152 |
| logD: | 4.4097 |
| logSw: | -4.3302 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 70.394 |
| InChI Key: | AYMWSOYDOGVUDG-UHFFFAOYSA-N |