4-{3-[4-(furan-2-carbonyl)piperazine-1-sulfonyl]-4-methylphenyl}-5,6,7,8-tetrahydrophthalazin-1(2H)-one
Chemical Structure Depiction of
4-{3-[4-(furan-2-carbonyl)piperazine-1-sulfonyl]-4-methylphenyl}-5,6,7,8-tetrahydrophthalazin-1(2H)-one
4-{3-[4-(furan-2-carbonyl)piperazine-1-sulfonyl]-4-methylphenyl}-5,6,7,8-tetrahydrophthalazin-1(2H)-one
Compound characteristics
| Compound ID: | D315-1938 |
| Compound Name: | 4-{3-[4-(furan-2-carbonyl)piperazine-1-sulfonyl]-4-methylphenyl}-5,6,7,8-tetrahydrophthalazin-1(2H)-one |
| Molecular Weight: | 482.56 |
| Molecular Formula: | C24 H26 N4 O5 S |
| Smiles: | Cc1ccc(cc1S(N1CCN(CC1)C(c1ccco1)=O)(=O)=O)C1C2CCCCC=2C(NN=1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.3832 |
| logD: | 3.3824 |
| logSw: | -3.7874 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 93.296 |
| InChI Key: | FWQVMTVUWLAAFT-UHFFFAOYSA-N |