2-ethyl-4-[4-ethyl-3-(pyrrolidine-1-sulfonyl)phenyl]-5,6,7,8-tetrahydrophthalazin-1(2H)-one
Chemical Structure Depiction of
2-ethyl-4-[4-ethyl-3-(pyrrolidine-1-sulfonyl)phenyl]-5,6,7,8-tetrahydrophthalazin-1(2H)-one
2-ethyl-4-[4-ethyl-3-(pyrrolidine-1-sulfonyl)phenyl]-5,6,7,8-tetrahydrophthalazin-1(2H)-one
Compound characteristics
| Compound ID: | D505-0683 |
| Compound Name: | 2-ethyl-4-[4-ethyl-3-(pyrrolidine-1-sulfonyl)phenyl]-5,6,7,8-tetrahydrophthalazin-1(2H)-one |
| Molecular Weight: | 415.55 |
| Molecular Formula: | C22 H29 N3 O3 S |
| Smiles: | CCc1ccc(cc1S(N1CCCC1)(=O)=O)C1C2CCCCC=2C(N(CC)N=1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.3437 |
| logD: | 4.3437 |
| logSw: | -4.2121 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 59.461 |
| InChI Key: | QVPQSYIZQKGMBI-UHFFFAOYSA-N |