Cas no 61815-21-2 (4-Imidazolidinone, 5-cyclohexyl-3-phenyl-2-thioxo-)
61815-21-2 structure
Product Name:4-Imidazolidinone, 5-cyclohexyl-3-phenyl-2-thioxo-
CAS No:61815-21-2
MF:C15H18N2OS
MW:274.381222248077
CID:465418
PubChem ID:12518915
Update Time:2025-04-19
4-Imidazolidinone, 5-cyclohexyl-3-phenyl-2-thioxo- Chemical and Physical Properties
Names and Identifiers
-
- 4-Imidazolidinone, 5-cyclohexyl-3-phenyl-2-thioxo-
- 5-cyclohexyl-3-phenyl-2-sulfanylideneimidazolidin-4-one
- DTXSID40501122
- 61815-21-2
-
- Inchi： 1S/C15H18N2OS/c18-14-13(11-7-3-1-4-8-11)16-15(19)17(14)12-9-5-2-6-10-12/h2,5-6,9-11,13H,1,3-4,7-8H2,(H,16,19)
- InChI Key： XWYCHNZOXCMMFH-UHFFFAOYSA-N
- SMILES： S=C1N(C2C=CC=CC=2)C(C(C2CCCCC2)N1)=O
Computed Properties
- Exact Mass: 274.11414
- Monoisotopic Mass: 274.11398438g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 19
- Rotatable Bond Count: 2
- Complexity: 359
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 1
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 3.7
- Topological Polar Surface Area: 64.4?2
Experimental Properties
- PSA: 32.34
4-Imidazolidinone, 5-cyclohexyl-3-phenyl-2-thioxo- Related Literature
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Max Attwood,Hiroki Akutsu,Lee Martin,Toby J. Blundell,Pierre Le Maguere,Scott S. Turner Dalton Trans., 2021,50, 11843-11851
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Peiyuan Zeng,Xiaoxiao Wang,Ming Ye,Qiuyang Ma,Jianwen Li,Wanwan Wang,Baoyou Geng,Zhen Fang RSC Adv., 2016,6, 23074-23084
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Fereshteh Bayat Environ. Sci.: Nano, 2021,8, 367-389
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Craig A. Kelly,David R. Rosseinsky Phys. Chem. Chem. Phys., 2001,3, 2086-2090
61815-21-2 (4-Imidazolidinone, 5-cyclohexyl-3-phenyl-2-thioxo-) Related Products
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