AC1Q3EFY
2-(diethylamino)ethyl 4-oxo-3-phenylphthalazine-1-carboxylate;hydrochloride
Also Known As: 5-chloro-3-iodopyridin-2-ylamine|1-Phthalazinecarboxylic acid, 4-oxo-3-phenyl-, 2-(diethylamino)ethyl ester, hydrochloride|4-Oxo-3-phenyl-1-phthalazinecarboxylic acid, 2-(diethylamino)ethyl ester, hydrochloride|2-(diethylamino)ethyl 4-oxo-3-phenyl-3,4-dihydrophthalazine-1-carboxylate hydrochloride(1:1)|2-(diethylamino)ethyl 4-oxo-3-phenylphthalazine-1-carboxylate,hydrochloride|2-diethylaminoethyl 4-oxo-3-phenylphthalazine-1-carboxylate hydrochloride|2-(Diethylamino)ethyl 4-oxo-3-phenyl-3,4-dihydrophthalazine-1-carboxylate--hydrogen chloride (1/1)
| Molecular Formula | C21H24ClN3O3 |
|---|---|
| Molecular Weight | 401.1506 g/mol |
| LogP | 3.3061 |
| Topological Polar Surface Area | 62.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 8 |
| Exact Mass | 401.1506 |
| Monoisotopic Mass | 401.1506 |
| Heavy Atoms | 28 |
| Complexity | 553.0 |
Chemical Identifiers
| CAS Number | 23959-69-5 |
|---|---|
| SMILES | CCN(CC)CCOC(=O)C1=NN(C(=O)C2=CC=CC=C21)C3=CC=CC=C3.Cl |
| InChIKey | LGZRJGIWUUCCFL-UHFFFAOYSA-N |
Product Overview
AC1Q3EFY (CAS 23959-69-5), with molecular formula C21H24ClN3O3 and molecular weight 401.1506 g/mol. IUPAC: 2-(diethylamino)ethyl 4-oxo-3-phenylphthalazine-1-carboxylate;hydrochloride.
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