247117-88-0
2-(4-[(4-METHOXYPHENYL)METHYL]PIPERAZIN-1-YL)PYRIDINE-3-CARBOXYLIC ACID
Name2-(4-[(4-METHOXYPHENYL)METHYL]PIPERAZIN-1-YL)PYRIDINE-3-CARBOXYLIC ACID
1Identification
【Name】
2-(4-[(4-METHOXYPHENYL)METHYL]PIPERAZIN-1-YL)PYRIDINE-3-CARBOXYLIC ACID
【CAS】
【MDL】
MFCD14705693
【中文同义词】
【EnglishSynonyms】
【pro_formula】
C18 H21 N3 O3
【pro_molWeight】
327.382
【Inchi】
InChI=1S/C18H21N3O3/c1-24-15-6-4-14(5-7-15)13-20-9-11-21(12-10-20)17-16(18(22)23)3-2-8-19-17/h2-8H,9-13H2,1H3,(H,22,23)
【InChIKey】
InChIKey=UQDWQMMXZPVSIX-UHFFFAOYSA-N
【SMILES】
COc1ccc(cc1)CN2CCN(CC2)c3c(cccn3)C(=O)O
【MOL File】
2-(4-[(4-METHOXYPHEN….mol
2ChemicalProperties
【ComputedProperties】
pro_donors:1
pro_acceptors:6
XLogP3:3.0
Bulk/Fine:F
3MaterialMSDS
4CMLFile
2-(4-[(4-METHOXYPHENYL)METHYL]PIPERAZIN-1-YL)PYRIDINE-3-CARBOXYLIC ACID.cml