N-[(1-oxophthalazin-2(1H)-yl)acetyl]-L-alanine
Chemical Structure Depiction of
N-[(1-oxophthalazin-2(1H)-yl)acetyl]-L-alanine
N-[(1-oxophthalazin-2(1H)-yl)acetyl]-L-alanine
Compound characteristics
| Compound ID: | Y043-1522 |
| Compound Name: | N-[(1-oxophthalazin-2(1H)-yl)acetyl]-L-alanine |
| Molecular Weight: | 275.26 |
| Molecular Formula: | C13 H13 N3 O4 |
| Smiles: | C[C@@H](C(O)=O)NC(CN1C(c2ccccc2C=N1)=O)=O |
| Stereo: | ABSOLUTE |
| logP: | -1.0335 |
| logD: | -4.7242 |
| logSw: | -2.3686 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 80.544 |
| InChI Key: | FYVFXLWDIIXILY-QMMMGPOBSA-N |