[4-oxo-3-(propan-2-yl)-3,4-dihydrophthalazin-1-yl]acetic acid
Chemical Structure Depiction of
[4-oxo-3-(propan-2-yl)-3,4-dihydrophthalazin-1-yl]acetic acid
[4-oxo-3-(propan-2-yl)-3,4-dihydrophthalazin-1-yl]acetic acid
Compound characteristics
| Compound ID: | D216-0413 |
| Compound Name: | [4-oxo-3-(propan-2-yl)-3,4-dihydrophthalazin-1-yl]acetic acid |
| Molecular Weight: | 246.26 |
| Molecular Formula: | C13 H14 N2 O3 |
| Smiles: | CC(C)N1C(c2ccccc2C(CC(O)=O)=N1)=O |
| Stereo: | ACHIRAL |
| logP: | 1.5301 |
| logD: | -1.9995 |
| logSw: | -2.0803 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.939 |
| InChI Key: | LBVITQCHGOFTGO-UHFFFAOYSA-N |