Cas no 5779-20-4 (Thiourea, N-[4-(dimethylamino)phenyl]-N'-phenyl-)
![Thiourea, N-[4-(dimethylamino)phenyl]-N'-phenyl- structure](https://ossimg.kuujia.com/scimg/6000/5779-20-4x500.png)
5779-20-4 structure
Product Name:Thiourea, N-[4-(dimethylamino)phenyl]-N'-phenyl-
CAS No:5779-20-4
MF:C15H17N3S
MW:271.380581617355
CID:344168
Update Time:2024-01-28
Thiourea, N-[4-(dimethylamino)phenyl]-N'-phenyl- Chemical and Physical Properties
Names and Identifiers
-
- Thiourea, N-[4-(dimethylamino)phenyl]-N'-phenyl-
- 1-(4-(DIMETHYLAMINO)PHENYL)-3-(PHENYL)-2-THIOUREA
- 1-[4-(dimethylamino)phenyl]-3-phenylthiourea
-
- Inchi： 1S/C15H17N3S/c1-18(2)14-10-8-13(9-11-14)17-15(19)16-12-6-4-3-5-7-12/h3-11H,1-2H3,(H2,16,17,19)
- InChI Key： HABOTJOLVOHPAA-UHFFFAOYSA-N
- SMILES： N(C1=CC=C(N(C)C)C=C1)C(NC1=CC=CC=C1)=S
Computed Properties
- Exact Mass: 271.11451
- Monoisotopic Mass: 271.114
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 19
- Rotatable Bond Count: 3
- Complexity: 279
- 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: 2.3
Experimental Properties
- PSA: 27.3
Thiourea, N-[4-(dimethylamino)phenyl]-N'-phenyl- Related Literature
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Patricia A. A. M. Vaz,Jo?o Rocha,Artur M. S. Silva New J. Chem., 2016,40, 8198-8201
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James D. Kirkham,Patrick M. Delaney,George J. Ellames,Eleanor C. Row,Joseph P. A. Harrity Chem. Commun., 2010,46, 5154-5156
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Suji Lee,Min Su Han Chem. Commun., 2021,57, 9450-9453
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Haitao Li,Yu Pan,Zhizhi Wang,Shan Chen,Ruixin Guo,Jianqiu Chen RSC Adv., 2015,5, 100775-100782
5779-20-4 (Thiourea, N-[4-(dimethylamino)phenyl]-N'-phenyl-) Related Products
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