N-{2-[(4-chlorophenyl)sulfanyl]ethyl}-3-methyl-4-oxo-3,4-dihydrophthalazine-1-carboxamide
Chemical Structure Depiction of
N-{2-[(4-chlorophenyl)sulfanyl]ethyl}-3-methyl-4-oxo-3,4-dihydrophthalazine-1-carboxamide
N-{2-[(4-chlorophenyl)sulfanyl]ethyl}-3-methyl-4-oxo-3,4-dihydrophthalazine-1-carboxamide
Compound characteristics
| Compound ID: | Y041-9415 |
| Compound Name: | N-{2-[(4-chlorophenyl)sulfanyl]ethyl}-3-methyl-4-oxo-3,4-dihydrophthalazine-1-carboxamide |
| Molecular Weight: | 373.86 |
| Molecular Formula: | C18 H16 Cl N3 O2 S |
| Smiles: | CN1C(c2ccccc2C(C(NCCSc2ccc(cc2)[Cl])=O)=N1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.7765 |
| logD: | 2.7765 |
| logSw: | -3.7278 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 51.672 |
| InChI Key: | DTUOIYHHMBNDGB-UHFFFAOYSA-N |