|
Structure
|
|
| Relationships |
Total Number of functionally related protein(s) :
1
Total Number of Articles : 3
|
| PubChem |
78323835
|
| Molecular Formula |
C14H21N5O2S |
| SMILES |
CCCS(=O)(=O)NC1CC(C1)N(C)C2=NC=NC3=C2C=CN3 |
| InChI |
InChI=1S/C14H21N5O2S/c1-3-6-22(20,21)18-10-7-11(8-10)19(2)14-12-4-5-15-13(12)16-9-17-14/h4-5,9-11,18H,3,6-8H2,1-2H3,(H,15,16,17) |
| synonyms |
- Abrocitinib
- 1622902-68-4
- PF-04965842
- Cibinqo
- N-[cis-3-[Methyl(7H-pyrrolo[2,3-d]pyrimidin-4-yl)amino]cyclobutyl]propane-1-sulfonamide
- Abrocitinib [USAN]
- 73SM5SF3OR
- CHEMBL4101725
- PF-04965842 (Abrocitinib)
- N-{cis-3-[methyl(7H-pyrrolo[2,3-d]pyrimidin-4-yl)amino]cyclobutyl}propane-1-sulfonamide
- N-[3-[methyl(7H-pyrrolo[2,3-d]pyrimidin-4-yl)amino]cyclobutyl]propane-1-sulfonamide
- 1-Propanesulfonamide, N-(cis-3-(methyl-7H-pyrrolo(2,3-d)pyrimidin-4-ylamino)cyclobutyl)-
- N-(3-(Methyl(7H-pyrrolo(2,3-d)pyrimidin-4-yl)amino)cyclobutyl)propane-1-sulfonamide, cis-
- N-[cis-3-(Methyl-7H-pyrrolo[2,3-d]pyrimidin-4-ylamino)cyclobutyl]-1-propanesulfonamide
- UNII-73SM5SF3OR
- N-(cis-3-(Methyl(7H-pyrrolo(2,3-d)pyrimidin-4-yl)amino)cyclobutyl)propane-1-sulfonamide
- N-(cis-3-(Methyl(7H-pyrrolo[2,3-d]pyrimidin-4-yl)amino)cyclobutyl)propane-1-sulfonamide
- N-{3-[methyl(7H-pyrrolo[2,3-d]pyrimidin-4-yl)amino]cyclobutyl}propane-1-sulfonamide
- D7D
- N-((1S,3S)-3-(METHYL(7H-PYRROLO(2,3-D)PYRIMIDIN-4-YL)AMINO)CYCLOBUTYL)PROPANE-1-SULFONAMIDE
- N-((1s,3s)-3-(methyl(7H-pyrrolo[2,3-d]pyrimidin-4-yl)amino)cyclobutyl)propane-1-sulfonamide
- ABROCITINIB [INN]
- ABROCITINIB [JAN]
- Abrocitinib (JAN/USAN)
- ABROCITINIB [WHO-DD]
- GTPL9991
- CHEMBL3655081
- SCHEMBL15970412
- SCHEMBL15970413
- PF-04965842(Abrocitinib)
Click to show/hide the synonyms
|
| Properties |
| Property |
Value |
| MW |
323.42 g/mol |
| HBD |
2 |
| HBA |
6 |
| Rotatable Bond Count |
6 |
| Exact Mass |
323.14159610 g/mol |
| Monoisotopic Mass |
323.14159610 g/mol |
| Heavy Atom Count |
22 |
| Isotope Atom Count |
0 |
| Atom Stereo Count |
0 |
| Covalent Unit Count |
1 |
| Complexity |
474 |
| xlogp |
1.7 |
| Topological Polar Surface Area |
99.4 |
|