N-butyl-5-(4-{4-[chloro(difluoro)methoxy]anilino}phthalazin-1-yl)-2-methylbenzene-1-sulfonamide
Chemical Structure Depiction of
N-butyl-5-(4-{4-[chloro(difluoro)methoxy]anilino}phthalazin-1-yl)-2-methylbenzene-1-sulfonamide
N-butyl-5-(4-{4-[chloro(difluoro)methoxy]anilino}phthalazin-1-yl)-2-methylbenzene-1-sulfonamide
Compound characteristics
| Compound ID: | 8012-7581 |
| Compound Name: | N-butyl-5-(4-{4-[chloro(difluoro)methoxy]anilino}phthalazin-1-yl)-2-methylbenzene-1-sulfonamide |
| Molecular Weight: | 547.02 |
| Molecular Formula: | C26 H25 Cl F2 N4 O3 S |
| Smiles: | CCCCNS(c1cc(ccc1C)c1c2ccccc2c(Nc2ccc(cc2)OC(F)(F)[Cl])nn1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 7.0006 |
| logD: | 6.9999 |
| logSw: | -6.5279 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 80.13 |
| InChI Key: | BUBDENMPERETRN-UHFFFAOYSA-N |