Cas no 832146-09-5 (N-(1,2,3,4-Tetrahydronaphthalen-1-yl)-4,5,6,7-tetrahydro-1,2-benzoxazole-3-carboxamide)
832146-09-5 structure
Product Name:N-(1,2,3,4-Tetrahydronaphthalen-1-yl)-4,5,6,7-tetrahydro-1,2-benzoxazole-3-carboxamide
CAS No:832146-09-5
MF:C18H20N2O2
MW:296.363604545593
CID:2109601
Update Time:2023-08-04
N-(1,2,3,4-Tetrahydronaphthalen-1-yl)-4,5,6,7-tetrahydro-1,2-benzoxazole-3-carboxamide Chemical and Physical Properties
Names and Identifiers
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- N-(1,2,3,4-tetrahydronaphthalen-1-yl)-4,5,6,7-tetrahydrobenzo[d]isoxazole-3-carboxamide
- N-(1,2,3,4-Tetrahydronaphthalen-1-yl)-4,5,6,7-tetrahydro-1,2-benzoxazole-3-carboxamide
-
- Inchi： 1S/C18H20N2O2/c21-18(17-14-9-3-4-11-16(14)22-20-17)19-15-10-5-7-12-6-1-2-8-13(12)15/h1-2,6,8,15H,3-5,7,9-11H2,(H,19,21)
- InChI Key： GGPJJQGVIBTUOD-UHFFFAOYSA-N
- SMILES： O1C2CCCCC=2C(C(NC2C3C=CC=CC=3CCC2)=O)=N1
Computed Properties
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 22
- Rotatable Bond Count: 2
- Complexity: 414
- Topological Polar Surface Area: 55.1
N-(1,2,3,4-Tetrahydronaphthalen-1-yl)-4,5,6,7-tetrahydro-1,2-benzoxazole-3-carboxamide Related Literature
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Kanjun Sun,Fengting Hua,Shuzhen Cui,Yanrong Zhu,Hui Peng,Guofu Ma RSC Adv., 2021,11, 37631-37642
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Adeline Huiling Loo,Alessandra Bonanni,Martin Pumera Analyst, 2013,138, 467-471
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Luis Miguel Azofra,Douglas R. MacFarlane,Chenghua Sun Chem. Commun., 2016,52, 3548-3551
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Inês S. Albuquerque,Hélia F. Jeremias,Miguel Chaves-Ferreira,Dijana Matak-Vinkovic,Omar Boutureira,Carlos C. Rom?o Chem. Commun., 2015,51, 3993-3996
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