596809-92-6
3-[3-[4-[3-(4-CYANOPHENOXY)PROPYL]-2,3-DIOXO-1-PIPERAZINYL]PROPOXY]-BENZONITRILE
Name
3-[3-[4-[3-(4-CYANOPHENOXY)PROPYL]-2,3-DIOXO-1-PIPERAZINYL]PROPOXY]-BENZONITRILE
Formula
C24 H24 N4 O4
MolWeight
432.478
1Identification
【Name】
3-[3-[4-[3-(4-CYANOPHENOXY)PROPYL]-2,3-DIOXO-1-PIPERAZINYL]PROPOXY]-BENZONITRILE
【CAS】
【MDL】
MFCD22051557
【English Synonyms】
【Formula】
C24 H24 N4 O4
【MolWeight】
432.478
【Inchi】
InChI=1S/C24H24N4O4/c25-17-19-6-8-21(9-7-19)31-14-2-10-27-12-13-28(24(30)23(27)29)11-3-15-32-22-5-1-4-20(16-22)18-26/h1,4-9,16H,2-3,10-15H2
【InChIKey】
InChIKey=HSGIXCJNUATTTK-UHFFFAOYSA-N
【SMILES】
c1cc(cc(c1)OCCCN2CCN(C(=O)C2=O)CCCOc3ccc(cc3)C#N)C#N
【MOL File】
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:8
XLogP3:2.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
3-[3-[4-[3-(4-CYANOPHENOXY)PROPYL]-2,3-DIOXO-1-PIPERAZINYL]PROPOXY]-BENZONITRILE.cml
Quick Release
(BUTAN-2-YL)((2,2-DIMETHYL-3-[(2-METHYLPROPYL)AMINO]PROPYL))(2-METHOXYETHYL)AMINE
(BUTAN-2-YL)(2-METHOXYETHYL)((3-[(METHYLAMINO)METHYL]OXOLAN-3-YL)METHYL)AMINE
(2-([(BUTAN-2-YL)(2-METHOXYETHYL)AMINO]METHYL)-2-METHYLBUTYL)(PROPYL)AMINE
(1-(2-[(ETHYLAMINO)METHYL]-2-METHYLPENTYL)PIPERIDIN-2-YL)METHANOL
2-[(2,6-DIMETHYLMORPHOLIN-4-YL)METHYL]-2-METHYLPENTANOIC ACID
1-(AZEPAN-1-YLMETHYL)CYCLOHEXANE-1-CARBOXYLIC ACID
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(2-([(BUTAN-2-YL)(2-METHOXYETHYL)AMINO]METHYL)-2-METHYLBUTYL)(PROPYL)AMINE
(1-(2-[(ETHYLAMINO)METHYL]-2-METHYLPENTYL)PIPERIDIN-2-YL)METHANOL
2-[(2,6-DIMETHYLMORPHOLIN-4-YL)METHYL]-2-METHYLPENTANOIC ACID
1-(AZEPAN-1-YLMETHYL)CYCLOHEXANE-1-CARBOXYLIC ACID