HuagongsheHuagongshe Chemistry Print Report · For research reference only
HCID 91231663Generated: October 30, 2026
Di(tert-butyl) ((2s)-1-(3-((4-((5-(2-((2,3-difluorophenyl)amino)-2-oxoethyl)-1,3-thiazol-2-yl)amino)-6-methoxyquinazolin-7-yl)oxy)propyl)pyrrolidin-2-yl)methyl phosphate
https://huagongshe.com/en/chemical/91231663
Identifiers & Physical Properties
| Molecular formula | C36H47F2N6O7PS |
|---|
| Average molar mass | 776.8 g/mol |
|---|
| Monoisotopic mass | 776.29326235 g/mol |
|---|
| SMILES | COc1cc2c(Nc3ncc(CC(=O)Nc4cccc(F)c4F)s3)ncnc2cc1OCCCN1CCC[C@H]1COP(=O)(OC(C)(C)C)OC(C)(C)C |
|---|
| InChIKey | HGMKNQHTDBCVFT-QHCPKHFHSA-N |
|---|
| PubChem CID | 91231663 |
|---|
Chemical & Physical Properties
| XLogP | 5.9 |
|---|
| Topological polar surface area | 175 |
|---|
| Hydrogen bond donors | 2 |
|---|
| Hydrogen bond acceptors | 15 |
|---|
| Rotatable bonds | 18 |
|---|
| Heavy atoms | 53 |
|---|
| Formal charge | 0 |
|---|
| Complexity | 1,200 |
|---|
