2-[(1,3-benzoxazol-2-yl)sulfanyl]-1-{4-[4-(4-methylphenyl)phthalazin-1-yl]piperazin-1-yl}ethan-1-one
Chemical Structure Depiction of
2-[(1,3-benzoxazol-2-yl)sulfanyl]-1-{4-[4-(4-methylphenyl)phthalazin-1-yl]piperazin-1-yl}ethan-1-one
2-[(1,3-benzoxazol-2-yl)sulfanyl]-1-{4-[4-(4-methylphenyl)phthalazin-1-yl]piperazin-1-yl}ethan-1-one
Compound characteristics
| Compound ID: | 6434-3712 |
| Compound Name: | 2-[(1,3-benzoxazol-2-yl)sulfanyl]-1-{4-[4-(4-methylphenyl)phthalazin-1-yl]piperazin-1-yl}ethan-1-one |
| Molecular Weight: | 495.6 |
| Molecular Formula: | C28 H25 N5 O2 S |
| Smiles: | Cc1ccc(cc1)c1c2ccccc2c(nn1)N1CCN(CC1)C(CSc1nc2ccccc2o1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.5273 |
| logD: | 5.527 |
| logSw: | -5.6579 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 58.186 |
| InChI Key: | FNPHTZJQFUJJGI-UHFFFAOYSA-N |