AC1Q3DYD
N-[2-(cyclohexylamino)ethyl]-1,2-benzothiazole-3-carboxamide;hydrochloride
Also Known As: N-(2-(Cyclohexylamino)ethyl)-1,2-benzisothiazole-3-carboxamide monohydrochloride|N-Cicloesil-N-(2-(1,2-benzitosiazol-3-ilcarbossiamido)etil)amina|N-Cicloesil-N-(2-(1,2-benzitosiazol-3-ilcarbossiamido)etil)amina [Italian]|1,2-Benzisothiazole-3-carboxamide, N-(2-(cyclohexylamino)ethyl)-, monohydrochloride|n-[2-(cyclohexylamino)ethyl]-1,2-benzothiazole-3-carboxamide hydrochloride(1:1)|N-[2-(cyclohexylamino)ethyl]-1,2-benzothiazole-3-carboxamide hydrochloride|N-[2-(Cyclohexylamino)ethyl]-1,2-benzothiazole-3-carboxamide--hydrogen chloride (1/1)
| Molecular Formula | C16H22ClN3OS |
|---|---|
| Molecular Weight | 339.11722 g/mol |
| LogP | 3.3702 |
| Topological Polar Surface Area | 82.3 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 339.11722 |
| Monoisotopic Mass | 339.11722 |
| Heavy Atoms | 22 |
| Complexity | 346.0 |
Chemical Identifiers
| CAS Number | 35531-85-2 |
|---|---|
| SMILES | C1CCC(CC1)NCCNC(=O)C2=NSC3=CC=CC=C32.Cl |
| InChIKey | MESSJADDSHXFBN-UHFFFAOYSA-N |
Product Overview
AC1Q3DYD (CAS 35531-85-2), with molecular formula C16H22ClN3OS and molecular weight 339.11722 g/mol. IUPAC: N-[2-(cyclohexylamino)ethyl]-1,2-benzothiazole-3-carboxamide;hydrochloride.