Cas no 21267-94-7 (N-(4-chlorophenyl)-9-[5-(diethylamino)pentan-2-yl]purin-6-amine)
![N-(4-chlorophenyl)-9-[5-(diethylamino)pentan-2-yl]purin-6-amine structure](https://ossimg.kuujia.com/scimg/21500/21267-94-7x500.png)
21267-94-7 structure
Product Name:N-(4-chlorophenyl)-9-[5-(diethylamino)pentan-2-yl]purin-6-amine
CAS No:21267-94-7
MF:C20H27ClN6
MW:386.921582460403
CID:911427
PubChem ID:419122
Update Time:2025-04-19
N-(4-chlorophenyl)-9-[5-(diethylamino)pentan-2-yl]purin-6-amine Chemical and Physical Properties
Names and Identifiers
-
- N-(4-chlorophenyl)-9-[5-(diethylamino)pentan-2-yl]purin-6-amine
- AC1L9H2K
- AG-E-55916
- CTK4E6274
- N-(4-CHLOROPHENYL)-9-(5-DIETHYLAMINOPENTAN-2-YL)PURIN-6-AMINE
- DTXSID80329286
- DS-011601
- 21267-94-7
-
- Inchi： 1S/C20H27ClN6/c1-4-26(5-2)12-6-7-15(3)27-14-24-18-19(22-13-23-20(18)27)25-17-10-8-16(21)9-11-17/h8-11,13-15H,4-7,12H2,1-3H3,(H,22,23,25)
- InChI Key： HDPHUPANXHISGP-UHFFFAOYSA-N
- SMILES： ClC1C=CC(=CC=1)NC1=C2C(=NC=N1)N(C=N2)C(C)CCCN(CC)CC
Computed Properties
- Exact Mass: 386.19891
- Monoisotopic Mass: 386.199
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 5
- Heavy Atom Count: 27
- Rotatable Bond Count: 9
- Complexity: 427
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 1
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 4.4
- Topological Polar Surface Area: 58.9?2
Experimental Properties
- Density: 1.22
- Boiling Point: 544.3°C at 760 mmHg
- Flash Point: 283°C
- Refractive Index: 1.621
- PSA: 58.87
- LogP: 5.78130
N-(4-chlorophenyl)-9-[5-(diethylamino)pentan-2-yl]purin-6-amine Related Literature
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Ana G. Neo,Ana Bornadiego,Jesús Díaz,Stefano Marcaccini,Carlos F. Marcos Org. Biomol. Chem., 2013,11, 6546-6555
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Weili Dai,Guangjun Wu,Michael Hunger Chem. Commun., 2015,51, 13779-13782
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Thi Thu Tram Nguyen,Thanh Binh Nguyen Org. Biomol. Chem., 2021,19, 6015-6020
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Yaling Zhang,Chunhui Dai,Shiwei Zhou,Bin Liu Chem. Commun., 2018,54, 10092-10095
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Maomao Hou,Fenglin Zhong,Qiu Jin,Enjiang Liu,Jie Feng,Tengyun Wang,Yue Gao RSC Adv., 2017,7, 34392-34400
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