78372-06-2
1-(2-(DIMETHYLAMINO)ETHYL)-1-ISOPROPYL-3-(2,6-XYLYL)UREA HYDROCHLORIDE
Name1-(2-(DIMETHYLAMINO)ETHYL)-1-ISOPROPYL-3-(2,6-XYLYL)UREA HYDROCHLORIDE
pro_formulaC16 H27 N3 O . Cl H
1Identification
【Name】
1-(2-(DIMETHYLAMINO)ETHYL)-1-ISOPROPYL-3-(2,6-XYLYL)UREA HYDROCHLORIDE
【CAS】
【MDL】
MFCD01676293
【中文同义词】
【EnglishSynonyms】
【pro_formula】
C16 H27 N3 O . Cl H
【pro_molWeight】
313.87
【Inchi】
InChI=1S/C16H27N3O.ClH/c1-12(2)19(11-10-18(5)6)16(20)17-15-13(3)8-7-9-14(15)4;/h7-9,12H,10-11H2,1-6H3,(H,17,20);1H
【InChIKey】
InChIKey=PSADZATXJXTFLW-UHFFFAOYSA-N
【SMILES】
Cc1cccc(c1NC(=O)N(CCN(C)C)C(C)C)C.Cl
【MOL File】
1-(2-(DIMETHYLAMINO)….mol
2ChemicalProperties
【ComputedProperties】
pro_donors:1
pro_acceptors:4
XLogP3:3.0
Bulk/Fine:F
3MaterialMSDS
4CMLFile
1-(2-(DIMETHYLAMINO)ETHYL)-1-ISOPROPYL-3-(2,6-XYLYL)UREA HYDROCHLORIDE.cml