| CAS Number | 195193-10-3 |
| Catalog Number | AG01BDNF(AGN-PC-00OUYT) |
| Chemical Name | 5-phenylthieno[2,3-d]pyrimidin-4-amine |
| IUPAC Name | 5-phenylthieno[2,3-d]pyrimidin-4-amine |
| InChI | InChI=1S/C12H9N3S/c13-11-10-9(8-4-2-1-3-5-8)6-16-12(10)15-7-14-11/h1-7H,(H2,13,14,15) |
| InChI Key | QKUFEXGLTQADSA-UHFFFAOYSA-N |
| MDL Number | MFCD07387962 |
| Molecular Formula | C12H9N3S |
| Molecular Weight | 227.2850 |
| SMILES | NC1=C2C(SC=C2C2=CC=CC=C2)=NC=N1 |
| Synonyms | 5-Phenylthieno[2,3-d]pyrimidin-4-amine,
195193-10-3,
Kinome_2191,
CHEMBL1975212,
SCHEMBL14013968,
ZINC20320970,
AKOS000369067,
Z276844694,
|
| Complexity | 242 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 227.052g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 16 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 227.285g/mol |
| Monoisotopic Mass | 227.052g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 80A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.8 |
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Certificate of Analysis
Lot Number