N-{2-[(4-{2-[4-(4-nitrophenyl)piperazin-1-yl]-2-oxoethyl}-1,3-thiazol-2-yl)amino]-2-oxoethyl}-N-propylfuran-2-carboxamide
Chemical Structure Depiction of
N-{2-[(4-{2-[4-(4-nitrophenyl)piperazin-1-yl]-2-oxoethyl}-1,3-thiazol-2-yl)amino]-2-oxoethyl}-N-propylfuran-2-carboxamide
N-{2-[(4-{2-[4-(4-nitrophenyl)piperazin-1-yl]-2-oxoethyl}-1,3-thiazol-2-yl)amino]-2-oxoethyl}-N-propylfuran-2-carboxamide
Compound characteristics
| Compound ID: | V001-3856 |
| Compound Name: | N-{2-[(4-{2-[4-(4-nitrophenyl)piperazin-1-yl]-2-oxoethyl}-1,3-thiazol-2-yl)amino]-2-oxoethyl}-N-propylfuran-2-carboxamide |
| Molecular Weight: | 540.6 |
| Molecular Formula: | C25 H28 N6 O6 S |
| Salt: | not_available |
| Smiles: | CCCN(CC(Nc1nc(CC(N2CCN(CC2)c2ccc(cc2)[N+]([O-])=O)=O)cs1)=O)C(c1ccco1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2488 |
| logD: | 3.2467 |
| logSw: | -3.3887 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 111.46 |
| InChI Key: | WODAOYGZZAZOOT-UHFFFAOYSA-N |