2-ethyl-4-[4-ethyl-3-(3-methylpiperidine-1-sulfonyl)phenyl]-5,6,7,8-tetrahydrophthalazin-1(2H)-one
Chemical Structure Depiction of
2-ethyl-4-[4-ethyl-3-(3-methylpiperidine-1-sulfonyl)phenyl]-5,6,7,8-tetrahydrophthalazin-1(2H)-one
2-ethyl-4-[4-ethyl-3-(3-methylpiperidine-1-sulfonyl)phenyl]-5,6,7,8-tetrahydrophthalazin-1(2H)-one
Compound characteristics
| Compound ID: | D505-0744 |
| Compound Name: | 2-ethyl-4-[4-ethyl-3-(3-methylpiperidine-1-sulfonyl)phenyl]-5,6,7,8-tetrahydrophthalazin-1(2H)-one |
| Molecular Weight: | 443.61 |
| Molecular Formula: | C24 H33 N3 O3 S |
| Smiles: | CCc1ccc(cc1S(N1CCCC(C)C1)(=O)=O)C1C2CCCCC=2C(N(CC)N=1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.9795 |
| logD: | 4.9795 |
| logSw: | -4.6188 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 59.028 |
| InChI Key: | KREHPZBKLYJRRH-KRWDZBQOSA-N |