Cas no 174503-70-9 (6-chloro-5-(4-chloronaphthalen-1-yl)oxy-2-methylsulfanyl-1h-benzimidazole)
174503-70-9 structure
Product Name:6-chloro-5-(4-chloronaphthalen-1-yl)oxy-2-methylsulfanyl-1h-benzimidazole
CAS No:174503-70-9
MF:C18H12Cl2N2OS
MW:375.271680831909
CID:1360003
PubChem ID:1207354
Update Time:2025-04-20
6-chloro-5-(4-chloronaphthalen-1-yl)oxy-2-methylsulfanyl-1h-benzimidazole Chemical and Physical Properties
Names and Identifiers
-
- 6-chloro-5-(4-chloronaphthalen-1-yl)oxy-2-methylsulfanyl-1h-benzimidazole
- G 1558
- 1H-Benzimidazole, 5-chloro-6-((4-chloro-1-naphthalenyl)oxy)-2-(methylthio)-
- 5-Chloro-6-((4-chloro-1-naphthalenyl)oxy)-2-(methylthio)-1H-benzimidazole
- AC1LNRLD
- Oprea1_818883
- CHEMBL2036059
- MolPort-003-818-576
- ZINC01513626
- LS-32754
- G 1558;
- AH-034/32474057
- 174503-70-9
- DTXSID00169843
- 6-chloro-5-[(4-chloro-1-naphthyl)oxy]-2-methylsulfanyl-1H-benzimidazole
-
- Inchi： 1S/C18H12Cl2N2OS/c1-24-18-21-14-8-13(20)17(9-15(14)22-18)23-16-7-6-12(19)10-4-2-3-5-11(10)16/h2-9H,1H3,(H,21,22)
- InChI Key： OSDDXEWTQZXREV-UHFFFAOYSA-N
- SMILES： ClC1=CC2=C(C=C1OC1=CC=C(C3C=CC=CC1=3)Cl)N=C(N2)SC
Computed Properties
- Exact Mass: 374.00500
- Monoisotopic Mass: 374.0047396g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 24
- Rotatable Bond Count: 3
- Complexity: 443
- 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: 6.4
- Topological Polar Surface Area: 63.2?2
Experimental Properties
- PSA: 63.21000
- LogP: 6.53710
6-chloro-5-(4-chloronaphthalen-1-yl)oxy-2-methylsulfanyl-1h-benzimidazole Related Literature
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Yong Ping Huang,Tao Tao,Zheng Chen,Wei Han,Ying Wu,Chunjiang Kuang,Shaoxiong Zhou,Ying Chen J. Mater. Chem. A, 2014,2, 18831-18837
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Xinhuan Wang,Shuangfei Cai,Cui Qi Analyst, 2017,142, 2500-2506
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4. Excimer emission and magnetoluminescence of radical-based zinc(ii) complexes doped in host crystals?Shojiro Kimura,Tetsuro Kusamoto Chem. Commun., 2020,56, 11195-11198
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Jing Yu,Yu-Qi Lyu,Jiapeng Liu,Mohammed B. Effat,Junxiong Wu J. Mater. Chem. A, 2019,7, 17995-18002
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