Cas no 6386-97-6 (3-chloro-N'-(1-naphthalen-2-ylethylidene)-1-benzothiophene-2-carbohydrazide)
6386-97-6 structure
Product Name:3-chloro-N'-(1-naphthalen-2-ylethylidene)-1-benzothiophene-2-carbohydrazide
CAS No:6386-97-6
MF:C21H15ClN2OS
MW:378.874602556229
CID:1661186
PubChem ID:5215754
Update Time:2025-04-21
3-chloro-N'-(1-naphthalen-2-ylethylidene)-1-benzothiophene-2-carbohydrazide Chemical and Physical Properties
Names and Identifiers
-
- 3-chloro-N'-(1-naphthalen-2-ylethylidene)-1-benzothiophene-2-carbohydrazide
- 3-chloro-N-(1-naphthalen-2-ylethylideneamino)-1-benzothiophene-2-carboxamide
- DTXSID40410604
- 3-Chloro-N'-[1-(naphthalen-2-yl)ethylidene]-1-benzothiophene-2-carbohydrazide
- 6386-97-6
-
- Inchi： 1S/C21H15ClN2OS/c1-13(15-11-10-14-6-2-3-7-16(14)12-15)23-24-21(25)20-19(22)17-8-4-5-9-18(17)26-20/h2-12H,1H3,(H,24,25)
- InChI Key： KMHSHNQCRNBTAF-UHFFFAOYSA-N
- SMILES： ClC1=C(C(NN=C(C)C2=CC=C3C=CC=CC3=C2)=O)SC2C=CC=CC=21
Computed Properties
- Exact Mass: 378.05955
- Monoisotopic Mass: 378.0593620g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 26
- Rotatable Bond Count: 3
- Complexity: 554
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 1
- XLogP3: 6.3
- Topological Polar Surface Area: 69.7?2
Experimental Properties
- PSA: 41.46
3-chloro-N'-(1-naphthalen-2-ylethylidene)-1-benzothiophene-2-carbohydrazide Related Literature
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Juan J. Sánchez,Miguel López-Haro,Juan C. Hernández-Garrido,Ginesa Blanco,Miguel A. Cauqui,José M. Rodríguez-Izquierdo,José A. Pérez-Omil,José J. Calvino,María P. Yeste J. Mater. Chem. A, 2019,7, 8993-9003
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Yaqing Liu,Jiangtao Ren,Jing Li,Jiyang Liu,Erkang Wang Chem. Commun., 2012,48, 802-804
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Luke L. Lairson,Warren W. Wakarchuk Chem. Commun., 2007, 365-367
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Hamid Heydari,Mohammad B. Gholivand New J. Chem., 2017,41, 237-244
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