2-methyl-4-[4-methyl-3-(morpholine-4-sulfonyl)phenyl]-5,6,7,8-tetrahydrophthalazin-1(2H)-one
Chemical Structure Depiction of
2-methyl-4-[4-methyl-3-(morpholine-4-sulfonyl)phenyl]-5,6,7,8-tetrahydrophthalazin-1(2H)-one
2-methyl-4-[4-methyl-3-(morpholine-4-sulfonyl)phenyl]-5,6,7,8-tetrahydrophthalazin-1(2H)-one
Compound characteristics
| Compound ID: | D505-0111 |
| Compound Name: | 2-methyl-4-[4-methyl-3-(morpholine-4-sulfonyl)phenyl]-5,6,7,8-tetrahydrophthalazin-1(2H)-one |
| Molecular Weight: | 403.5 |
| Molecular Formula: | C20 H25 N3 O4 S |
| Smiles: | Cc1ccc(cc1S(N1CCOCC1)(=O)=O)C1C2CCCCC=2C(N(C)N=1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.8748 |
| logD: | 2.8748 |
| logSw: | -3.2109 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 66.957 |
| InChI Key: | NPUVDBOXPMHNKC-UHFFFAOYSA-N |