Cas no 5180-30-3 (4,6-di(piperidin-1-yl)benzene-1,3-diamine)
5180-30-3 structure
Product Name:4,6-di(piperidin-1-yl)benzene-1,3-diamine
CAS No:5180-30-3
MF:C16H26N4
MW:274.404443264008
CID:1577142
PubChem ID:830672
Update Time:2025-04-21
4,6-di(piperidin-1-yl)benzene-1,3-diamine Chemical and Physical Properties
Names and Identifiers
-
- 4,6-di(piperidin-1-yl)benzene-1,3-diamine
- BAS 00431493
- AC1LH1OZ
- CBMicro_047834
- Oprea1_049632
- Oprea1_191980
- ZINC00353554
- AKOS000601355
- BIM-0047955.P001
- 4,6-Di-piperidin-1-yl-benzene-1,3-diamine
- BAS 00431493; AC1LH1OZ; CBMicro_047834; Oprea1_049632; Oprea1_191980; ZINC00353554; AKOS000601355; BIM-0047955.P001; 4,6-Di-piperidin-1-yl-benzene-1,3-diamine;
- DTXSID00356731
- 5180-30-3
-
- Inchi： 1S/C16H26N4/c17-13-11-14(18)16(20-9-5-2-6-10-20)12-15(13)19-7-3-1-4-8-19/h11-12H,1-10,17-18H2
- InChI Key： GNLQOMMONCHQTD-UHFFFAOYSA-N
- SMILES： N1(C2C(=CC(=C(C=2)N2CCCCC2)N)N)CCCCC1
Computed Properties
- Exact Mass: 274.21598
- Monoisotopic Mass: 274.21574685g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 20
- Rotatable Bond Count: 2
- Complexity: 269
- 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
- XLogP3: 2.5
- Topological Polar Surface Area: 58.5?2
Experimental Properties
- PSA: 58.52
4,6-di(piperidin-1-yl)benzene-1,3-diamine Related Literature
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David White,Sean R. Stowell Biomater. Sci., 2017,5, 463-474
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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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Gerald J. Meyer,Leif Hammarstr?m Chem. Sci., 2020,11, 3460-3473
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Zhixia Liu,Tingjian Chen,Floyd E. Romesberg Chem. Sci., 2017,8, 8179-8182
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