HuagongsheHuagongshe Chemistry Print Report · For research reference only
N-(4-chlorobenzoyl)-D-Tryptophan

Identifiers & Physical Properties
| CAS No. | 95672-29-0 |
|---|---|
| Molecular formula | C18H15ClN2O3 |
| Average molar mass | 342.8 g/mol |
| Monoisotopic mass | 342.07712 g/mol |
| SMILES | O=C(N[C@H](Cc1c[nH]c2ccccc12)C(=O)O)c1ccc(Cl)cc1 |
| InChIKey | QJERBBQXOMUURJ-MRXNPFEDSA-N |
| PubChem CID | 65813 |
| DTXSID | DTXSID801334222 |
Chemical & Physical Properties
| XLogP | 2.9 |
|---|---|
| Topological polar surface area | 82.2 |
| Hydrogen bond donors | 3 |
| Hydrogen bond acceptors | 3 |
| Rotatable bonds | 5 |
| Heavy atoms | 24 |
| Formal charge | 0 |
| Complexity | 465 |