HuagongsheHuagongshe Chemistry Print Report · For research reference only
Amh479WK9M
Identifiers & Physical Properties
| CAS No. | 2771087-32-0 |
|---|---|
| Molecular formula | C24H21N5O |
| Average molar mass | 395.5 g/mol |
| Monoisotopic mass | 395.17461031 g/mol |
| SMILES | N#Cc1c(-c2ccc(Oc3ccccc3)cc2)nn2c(C3CCNCC3)ccnc12 |
| InChIKey | PQIIEJPSGKNUHL-UHFFFAOYSA-N |
| PubChem CID | 163402619 |
Chemical & Physical Properties
| XLogP | 3.4 |
|---|---|
| Topological polar surface area | 75.2 |
| Hydrogen bond donors | 1 |
| Hydrogen bond acceptors | 5 |
| Rotatable bonds | 4 |
| Heavy atoms | 30 |
| Formal charge | 0 |
| Complexity | 600 |