| CAS Number | 203793-16-2 |
| Catalog Number | AG00CFN5(AGN-PC-01NRA9) |
| Chemical Name | 2-(Aminomethyl)thiazole-4-carboxamide |
| IUPAC Name | 2-(aminomethyl)-1,3-thiazole-4-carboxamide |
| InChI | InChI=1S/C5H7N3OS/c6-1-4-8-3(2-10-4)5(7)9/h2H,1,6H2,(H2,7,9) |
| InChI Key | VXKQIPWHZSQXLJ-UHFFFAOYSA-N |
| MDL Number | MFCD18821090 |
| Molecular Formula | C5H7N3OS |
| Molecular Weight | 157.1936 |
| SMILES | NCC1SC=C(C(N)=O)N=1 |
| Synonyms | 2-(aminomethyl)thiazole-4-carboxamide,
203793-16-2,
SCHEMBL2642449,
ZINC39065157,
AKOS013567556,
4-thiazolecarboxamide,2-(aminomethyl)-,
2-(aminomethyl)-1,3-thiazole-4-carboxamide,
4-Thiazolecarboxamide,2-(aminomethyl)-(9CI),
|
| Complexity | 141 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 157.031g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 10 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 157.191g/mol |
| Monoisotopic Mass | 157.031g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 110A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | -0.9 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number