Cas no 162857-95-6 (Holadienine; N-De-Me, N-(N-methylcarbamoyl))
162857-95-6 structure
Product Name:Holadienine; N-De-Me, N-(N-methylcarbamoyl)
CAS No:162857-95-6
MF:C23H32N2O2
MW:368.512386322021
CID:6623497
Update Time:2024-03-04
Holadienine; N-De-Me, N-(N-methylcarbamoyl) Chemical and Physical Properties
Names and Identifiers
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- Holadienine; N-De-Me, N-(N-methylcarbamoyl)
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- Inchi： 1S/C23H32N2O2/c1-14-18-6-7-20-17-5-4-15-12-16(26)8-10-22(15,2)19(17)9-11-23(18,20)13-25(14)21(27)24-3/h8,10,12,14,17-20H,4-7,9,11,13H2,1-3H3,(H,24,27)
- InChI Key： KNUQMCFQGBKYPW-UHFFFAOYSA-N
- SMILES： CNC(N1C(C)C2C3(C(CC2)C2CCC4C(C2CC3)(C)C=CC(=O)C=4)C1)=O
Computed Properties
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 27
- XLogP3: 4.327
Holadienine; N-De-Me, N-(N-methylcarbamoyl) Related Literature
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Marcin Czapla,Jack Simons Phys. Chem. Chem. Phys., 2018,20, 21739-21745
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Vishwesh Venkatraman,Marco Foscato,Vidar R. Jensen,Bj?rn K?re Alsberg J. Mater. Chem. A, 2015,3, 9851-9860
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Abdelaziz Houmam,Emad M. Hamed Chem. Commun., 2012,48, 11328-11330
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Shun-Ze Zhan,Mian Li,Xiao-Ping Zhou,Dan Li,Seik Weng Ng RSC Adv., 2011,1, 1457-1459
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