| CAS Number | 1318242-98-6 |
| Catalog Number | AG000ZSL(AGN-PC-0WCKBD) |
| Chemical Name | Thieno[3,2-d]pyrimidine-7-carboxylic acid, 4-amino- |
| IUPAC Name | 4-aminothieno[3,2-d]pyrimidine-7-carboxylic acid |
| InChI | InChI=1S/C7H5N3O2S/c8-6-5-4(9-2-10-6)3(1-13-5)7(11)12/h1-2H,(H,11,12)(H2,8,9,10) |
| InChI Key | XHAMZTOKACCSNT-UHFFFAOYSA-N |
| MDL Number | MFCD22571378 |
| Molecular Formula | C7H5N3O2S |
| Molecular Weight | 195.1985 |
| SMILES | O=C(C1=CSC2=C(N)N=CN=C21)O |
| Synonyms | 1318242-98-6,
4-aminothieno[3,2-d]pyrimidine-7-carboxylic acid,
4-AMINO-THIENO[3,2-D]PYRIMIDINE-7-CARBOXYLIC ACID,
SCHEMBL1492106,
MFCD22571378,
ZINC95742669,
FCH1812660,
PB32042,
KS-000007O6,
AC-30322,
AK171588,
AS-34764,
QC-10845,
SC-51673,
CS-0051031,
Q-4259,
Thieno[3,2-d]pyrimidine-7-carboxylic acid, 4-amino-,
|
| Complexity | 226 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 195.01g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 6 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 195.196g/mol |
| Monoisotopic Mass | 195.01g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 117A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.5 |
GHS Hazard and Precautionary Statements
| Symbol: | |
|
Hazard statements
|
|
|
Precautionary statements
|
|
Certificate of Analysis
Lot Number