N-[2-(1,2-dimethyl-1H-indol-3-yl)ethyl]-2-{4-[4-methyl-3-(morpholine-4-sulfonyl)phenyl]-1-oxophthalazin-2(1H)-yl}acetamide
Chemical Structure Depiction of
N-[2-(1,2-dimethyl-1H-indol-3-yl)ethyl]-2-{4-[4-methyl-3-(morpholine-4-sulfonyl)phenyl]-1-oxophthalazin-2(1H)-yl}acetamide
N-[2-(1,2-dimethyl-1H-indol-3-yl)ethyl]-2-{4-[4-methyl-3-(morpholine-4-sulfonyl)phenyl]-1-oxophthalazin-2(1H)-yl}acetamide
Compound characteristics
| Compound ID: | 8012-7680 |
| Compound Name: | N-[2-(1,2-dimethyl-1H-indol-3-yl)ethyl]-2-{4-[4-methyl-3-(morpholine-4-sulfonyl)phenyl]-1-oxophthalazin-2(1H)-yl}acetamide |
| Molecular Weight: | 613.74 |
| Molecular Formula: | C33 H35 N5 O5 S |
| Smiles: | Cc1ccc(cc1S(N1CCOCC1)(=O)=O)C1c2ccccc2C(N(CC(NCCc2c3ccccc3n(C)c2C)=O)N=1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.1349 |
| logD: | 3.1349 |
| logSw: | -3.4759 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 93.41 |
| InChI Key: | RROTWOBENXGLGS-UHFFFAOYSA-N |