(2S)-2-{[(benzyloxy)carbonyl]amino}-3-(3,5-difluorophenyl)propanoic acid
CAS: 1270301-77-3
| 1 | SCHEMBL3303033 |
| 2 | EN300-12616599 |
| 3 | (2S)-2-{[(benzyloxy)carbonyl]amino}-3-(3,5-difluorophenyl)propanoic acid |
No description available for this item
| Molecular Formula | C17H15F2NO4 |
|---|---|
| Canonical SMILES | |
| Isomeric SMILES | |
| Molecular Weight | 335.3000 |
| InChIKey | JVGDDKQQEGOELE-HNNXBMFYSA-N |
| InChI | InChI=1S/C17H15F2NO4/c18-13-6-12(7-14(19)9-13)8-15(16(21)22)20-17(23)24-10-11-4-2-1-3-5-11/h1-7,9,15H,8,10H2,(H,20,23)(H,21,22)/t15-/m0/s1 |
| XLogP | 2.3000 |
| ExactMass | 335.0969 |
| MonoisotopicMass | 335.0969 |
| TPSA | 75.6000 |
| Complexity | 419.0000 |
| Charge | 0.0000 |
| HBondDonorCount | 2 |
| HBondAcceptorCount | 6 |
| RotatableBondCount | 7 |
| HeavyAtomCount | 24 |
| IsotopeAtomCount | 0 |
| AtomStereoCount | 1 |
| DefinedAtomStereoCount | 1 |
| UndefinedAtomStereoCount | 0 |
| BondStereoCount | 0 |
| DefinedBondStereoCount | 0 |
| UndefinedBondStereoCount | 0 |
| CovalentUnitCount | 1 |
| PatentCount | 5 |
| PatentFamilyCount | 1 |
| LiteratureCount | 0 |