ethyl N-[4-(7-methoxy-4,5-dihydro-2H-benzo[g]indazol-3-yl)benzoyl]-beta-alaninate
Chemical Structure Depiction of
ethyl N-[4-(7-methoxy-4,5-dihydro-2H-benzo[g]indazol-3-yl)benzoyl]-beta-alaninate
ethyl N-[4-(7-methoxy-4,5-dihydro-2H-benzo[g]indazol-3-yl)benzoyl]-beta-alaninate
Compound characteristics
| Compound ID: | V011-2247 |
| Compound Name: | ethyl N-[4-(7-methoxy-4,5-dihydro-2H-benzo[g]indazol-3-yl)benzoyl]-beta-alaninate |
| Molecular Weight: | 419.48 |
| Molecular Formula: | C24 H25 N3 O4 |
| Salt: | not_available |
| Smiles: | CCOC(CCNC(c1ccc(cc1)c1c2CCc3cc(ccc3c2n[nH]1)OC)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.6341 |
| logD: | 3.634 |
| logSw: | -4.0028 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 76.238 |
| InChI Key: | OZAYKVBAFJWLAA-UHFFFAOYSA-N |