N-[(3-oxo-5,6,7,8-tetrahydrocinnolin-2(3H)-yl)acetyl]-L-leucine
Chemical Structure Depiction of
N-[(3-oxo-5,6,7,8-tetrahydrocinnolin-2(3H)-yl)acetyl]-L-leucine
N-[(3-oxo-5,6,7,8-tetrahydrocinnolin-2(3H)-yl)acetyl]-L-leucine
Compound characteristics
| Compound ID: | J103-0003 |
| Compound Name: | N-[(3-oxo-5,6,7,8-tetrahydrocinnolin-2(3H)-yl)acetyl]-L-leucine |
| Molecular Weight: | 321.37 |
| Molecular Formula: | C16 H23 N3 O4 |
| Smiles: | CC(C)C[C@@H](C(O)=O)NC(CN1C(C=C2CCCCC2=N1)=O)=O |
| Stereo: | ABSOLUTE |
| logP: | 0.1523 |
| logD: | -3.5077 |
| logSw: | -1.0441 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 81.014 |
| InChI Key: | MVCOXKYLMOQRCV-ZDUSSCGKSA-N |