5-(4-phenoxyphenyl)-7H-pyrrolo[2,3-d]pyriMidin-4-ylamine (CAS 330786-24-8) — formula C17H13N5O, molecular weight 303.32; category organic chemicals.
| CAS Number | 330786-24-8 |
|---|---|
| Molecular Formula | C17H13N5O |
| Molecular Weight | 303.32 |
| LogP | 3 |
| Category | Organic Chemicals |
5-(4-phenoxyphenyl)-7H-pyrrolo[2,3-d]pyriMidin-4-ylamine is a carbon-based organic compound with CAS registry number 330786-24-8 and molecular formula C17H13N5O (molecular weight 303.32), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 330786-24-8
Its molecular formula C17H13N5O comprises 17 C, 13 H, 5 N, 1 O atoms.
Also known as: 5-(4-phenoxyphenyl)-7H-pyrrolo[2,3-d]pyriMidin-4-ylamine · 5-(4-苯氧基苯基)-7H-吡咯并[2,3-d]吡啶-4-基胺
Category: organic chemicals
The CAS registry number of 5-(4-phenoxyphenyl)-7H-pyrrolo[2,3-d]pyriMidin-4-ylamine is 330786-24-8.
Molecular formula C17H13N5O, molecular weight 303.32.
It is also registered under: 5-(4-phenoxyphenyl)-7H-pyrrolo[2,3-d]pyriMidin-4-ylamine, 5-(4-苯氧基苯基)-7H-吡咯并[2,3-d]吡啶-4-基胺.
Category: Organic Chemicals.
Independent reference data for 5-(4-phenoxyphenyl)-7H-pyrrolo[2,3-d]pyriMidin-4-ylamine (CAS 330786-24-8), compiled from public chemistry databases.
| CAS Registry Number | 330786-24-8 |
|---|---|
| PubChem CID | 22346757 |
| Molecular formula | C17H13N5O |
| IUPAC name | 3-(4-phenoxyphenyl)-2H-pyrazolo[3,4-d]pyrimidin-4-amine |
| UNII (FDA) | KP2LL98299 |
| Molecular Weight | 303.32 |
|---|---|
| XLogP3 | 3 |
| Hydrogen Bond Donor Count | 2 |
| Hydrogen Bond Acceptor Count | 5 |
| Rotatable Bond Count | 3 |
| Exact Mass | 303.11201006 |
| Monoisotopic Mass | 303.11201006 |
| Topological Polar Surface Area | 89.7 |
| Heavy Atom Count | 23 |
330786-24-8; 3-(4-phenoxyphenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-amine; 3-(4-Phenoxyphenyl)-1H-pyrazolo(3,4-d)pyrimidin-4-amine; RefChem:493380; 810-090-0; Ibrutinib deacryloylpiperidine; Ibrutinib N-2; 4-Amino-3-(4-phenoxyphenyl)-1H-pyrazolo[3,4-d]pyrimidine; MFCD20270360; Ibrutinib Impurity 13; 3-(4-phenoxyphenyl)-2H-pyrazolo[3,4-d]pyrimidin-4-amine; C17H13N5O; IBT4A; SCHEMBL200349; CHEMBL1242204; 1H-Pyrazolo[3,4-d]pyrimidin-4-amine, 3-(4-phenoxyphenyl)-
| Reported hazard statements | H301 (25%), H302 (50%), H315 (25%), H319 (25%), H335 (25%), H400 (25%), H410 (25%) |
|---|
H301 (25%): Toxic if swallowed [Danger Acute toxicity, oral]
H302 (50%): Harmful if swallowed [Warning Acute toxicity, oral]
5-(4-phenoxyphenyl)-7H-pyrrolo[2,3-d]pyriMidin-4-ylamine · CAS 330786-24-8 · C17H13N5O. UNII KP2LL98299.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.