Cas no 25765-16-6 (3-Pyridinemethanol,4,4'-[hexamethylenebis(nitrilomethylidyne)]bis[5-hydroxy-6-methyl- (8CI))
![3-Pyridinemethanol,4,4'-[hexamethylenebis(nitrilomethylidyne)]bis[5-hydroxy-6-methyl- (8CI) structure](https://ossimg.kuujia.com/scimg/26000/25765-16-6x500.png)
25765-16-6 structure
Product Name:3-Pyridinemethanol,4,4'-[hexamethylenebis(nitrilomethylidyne)]bis[5-hydroxy-6-methyl- (8CI)
CAS No:25765-16-6
MF:C22H30N4O4
MW:414.498005390167
CID:287850
PubChem ID:360152
Update Time:2025-04-19
3-Pyridinemethanol,4,4'-[hexamethylenebis(nitrilomethylidyne)]bis[5-hydroxy-6-methyl- (8CI) Chemical and Physical Properties
Names and Identifiers
-
- 3-Pyridinemethanol,4,4'-[hexamethylenebis(nitrilomethylidyne)]bis[5-hydroxy-6-methyl- (8CI)
- (4Z)-5-(hydroxymethyl)-4-[[6-[[(Z)-[5-(hydroxymethyl)-2-methyl-3-oxopyridin-4-ylidene]methyl]amino]hexylamino]methylidene]-2-methylpyridin-3-one
- AC1NZDXO
- NSC376711
- NSC-376711
- 25765-16-6
- DTXSID20421379
- CHEMBL2097110
-
- Inchi： 1S/C22H30N4O4/c1-15-21(29)19(17(13-27)9-25-15)11-23-7-5-3-4-6-8-24-12-20-18(14-28)10-26-16(2)22(20)30/h9-12,27-30H,3-8,13-14H2,1-2H3/b23-11+,24-12+
- InChI Key： SNWKSXOYLZEWPI-ASIDMNOUSA-N
- SMILES： OC1C(C)=NC=C(CO)C=1/C=N/CCCCCC/N=C/C1=C(C(C)=NC=C1CO)O
Computed Properties
- Exact Mass: 414.2269
- Monoisotopic Mass: 414.22670545g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 4
- Hydrogen Bond Acceptor Count: 8
- Heavy Atom Count: 30
- Rotatable Bond Count: 11
- Complexity: 487
- 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: 0.4
- Topological Polar Surface Area: 131?2
Experimental Properties
- PSA: 123.38
- LogP: 2.58760
3-Pyridinemethanol,4,4'-[hexamethylenebis(nitrilomethylidyne)]bis[5-hydroxy-6-methyl- (8CI) Related Literature
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Stephen P. Fletcher,Richard B. C. Jagt,Ben L. Feringa Chem. Commun., 2007, 2578-2580
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Michael Kappl,Paul M. Young,Daniela Traini,Sanyog Jain RSC Adv., 2016,6, 25789-25798
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Alvin Tanudjaja,Shinsuke Inagi,Fusao Kitamura,Toshikazu Takata,Ikuyoshi Tomita Dalton Trans., 2021,50, 3037-3043
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