(S)-3,5-Dichloro-N-[(1-ethyl-2-pyrrolidinyl)methyl]-2,6-dihydroxy-benzamide

• CAS: 119670-11-0
• Catalog Number: ACM119670110
• Category: Other Products
• Molecular Weight: 333.2g/mol
• Molecular Formula: C14H18Cl2N2O3
• Synonyms: BENZAMIDE, 3,5-DICHLORO-N-[(1-ETHYL-2-PYRROLIDINYL)METHYL]-2,6-DIHYDROXY-, (S)-;O-DESMETHYLRACLOPRIDE;(S)-3,5-DICHLORO-N-[(1-ETHYL-2-PYRROLIDINYL)METHYL]-2,6-DIHYDROXY-BENZAMIDE;(S)-(+)-O-desmethylraclopride
• IUPAC Name: 3,5-dichloro-N-[[(2S)-1-ethylpyrrolidin-2-yl]methyl]-2,6-dihydroxybenzamide
• Canonical SMILES: CCN1CCCC1CNC(=O)C2=C(C(=CC(=C2O)Cl)Cl)O
• InChI: InChI=1S/C14H18Cl2N2O3/c1-2-18-5-3-4-8(18)7-17-14(21)11-12(19)9(15)6-10(16)13(11)20/h6,8,19-20H,2-5,7H2,1H3,(H,17,21)/t8-/m0/s1
• InChI Key: DPQOMEPZWBXAMA-QMMMGPOBSA-N
• Complexity: 358
• Covalently-Bonded Unit Count: 1
• Exact Mass: 332.069448g/mol
• Formal Charge: 0
• H-Bond Acceptor: 4
• H-Bond Donor: 3
• Heavy Atom Count: 21
• Monoisotopic Mass: 332.069448g/mol
• Rotatable Bond Count: 4
• XLogP3: 3.1