| CAS Number | 1251623-78-5 |
| Catalog Number | AG01AS2G(AGN-PC-0WCNQD) |
| Chemical Name | 2-Amino-N-carbamoyl-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxamide |
| IUPAC Name | 2-amino-N-carbamoyl-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxamide |
| InChI | InChI=1S/C9H11N3O2S/c10-7-6(8(13)12-9(11)14)4-2-1-3-5(4)15-7/h1-3,10H2,(H3,11,12,13,14) |
| InChI Key | WJQQXJCQWJBICR-UHFFFAOYSA-N |
| MDL Number | MFCD22587588 |
| Molecular Formula | C9H11N3O2S |
| Molecular Weight | 225.2675 |
| SMILES | NC1=C(C2=C(S1)CCC2)C(=O)NC(N)=O |
| Synonyms | 2-amino-N-carbamoyl-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxamide,
1251623-78-5,
AKOS024627508,
ZINC100968030,
MCULE-9794610722,
EN300-239779,
F2145-0310,
|
| Complexity | 297 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 225.057g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 3 |
| Isotope Atom Count | 0 |
| Molecular Weight | 225.266g/mol |
| Monoisotopic Mass | 225.057g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 126A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number