N-(1-benzyl-2,3-dihydro-1H-pyrrolo[2,3-b]quinolin-4-yl)-2-[4-(furan-2-carbonyl)piperazin-1-yl]acetamide--oxalic acid (1/1)
Chemical Structure Depiction of
N-(1-benzyl-2,3-dihydro-1H-pyrrolo[2,3-b]quinolin-4-yl)-2-[4-(furan-2-carbonyl)piperazin-1-yl]acetamide--oxalic acid (1/1)
N-(1-benzyl-2,3-dihydro-1H-pyrrolo[2,3-b]quinolin-4-yl)-2-[4-(furan-2-carbonyl)piperazin-1-yl]acetamide--oxalic acid (1/1)
Compound characteristics
Compound ID: | 8002-7403 |
Compound Name: | N-(1-benzyl-2,3-dihydro-1H-pyrrolo[2,3-b]quinolin-4-yl)-2-[4-(furan-2-carbonyl)piperazin-1-yl]acetamide--oxalic acid (1/1) |
Molecular Weight: | 585.62 |
Molecular Formula: | C29 H29 N5 O3 |
Salt: | HOOCCOOH |
Smiles: | C1CN(Cc2ccccc2)c2c1c(c1ccccc1n2)NC(CN1CCN(CC1)C(c1ccco1)=O)=O |
Stereo: | ACHIRAL |
logP: | 3.7323 |
logD: | 2.2939 |
logSw: | -4.1864 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 63.302 |
InChI Key: | DNTGLMZZZKCSGG-UHFFFAOYSA-N |