Cas no 6037-18-9 (1-(1-benzylpiperidin-4-yl)-4-(pyridin-4-ylmethyl)piperazine)
6037-18-9 structure
Product Name:1-(1-benzylpiperidin-4-yl)-4-(pyridin-4-ylmethyl)piperazine
CAS No:6037-18-9
MF:C22H30N4
MW:350.500404834747
CID:1620236
PubChem ID:1131783
Update Time:2025-04-21
1-(1-benzylpiperidin-4-yl)-4-(pyridin-4-ylmethyl)piperazine Chemical and Physical Properties
Names and Identifiers
-
- 1-(1-benzylpiperidin-4-yl)-4-(pyridin-4-ylmethyl)piperazine
- 1-(1-Benzyl-piperidin-4-yl)-4-pyridin-4-ylmethyl-piperazine
- piperazine, 1-[1-(phenylmethyl)-4-piperidinyl]-4-(4-pyridinylmethyl)-
- 6037-18-9
- CBMicro_041040
- 1-(1-BENZYL-4-PIPERIDYL)-4-(4-PYRIDYLMETHYL)PIPERAZINE
- DTXSID50360606
- Oprea1_583735
- STK135490
- Oprea1_230511
- AKOS003652127
- BIM-0041265.P001
-
- Inchi： 1S/C22H30N4/c1-2-4-20(5-3-1)18-24-12-8-22(9-13-24)26-16-14-25(15-17-26)19-21-6-10-23-11-7-21/h1-7,10-11,22H,8-9,12-19H2
- InChI Key： CUOIPOPLSVBPAD-UHFFFAOYSA-N
- SMILES： N1(CCN(CC2C=CN=CC=2)CC1)C1CCN(CC2C=CC=CC=2)CC1
Computed Properties
- Exact Mass: 350.2473
- Monoisotopic Mass: 350.247047g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 26
- Rotatable Bond Count: 5
- Complexity: 387
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Surface Charge: 0
- XLogP3: 2.6
- Topological Polar Surface Area: 22.6?2
Experimental Properties
- PSA: 22.61
- LogP: 2.6
1-(1-benzylpiperidin-4-yl)-4-(pyridin-4-ylmethyl)piperazine Related Literature
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Domenico Lombardo,Gianmarco Munaò,Pietro Calandra,Luigi Pasqua,Maria Teresa Caccamo Phys. Chem. Chem. Phys., 2019,21, 11983-11991
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Shintaro Takata,Yoshihiro Miura Phys. Chem. Chem. Phys., 2014,16, 24784-24789
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Hanie Hashtroudi,Ian D. R. Mackinnon J. Mater. Chem. C, 2020,8, 13108-13126
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Jason Y. C. Lim,Yong Yu,Guorui Jin,Kai Li,Yi Lu,Jianping Xie Nanoscale Adv., 2020,2, 3921-3932
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Abdelaziz Houmam,Emad M. Hamed Chem. Commun., 2012,48, 11328-11330
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