Cas no 37109-78-7 (9H-Purine,6-(hexylthio)-)
9H-Purine,6-(hexylthio)- structure
Product Name:9H-Purine,6-(hexylthio)-
CAS No:37109-78-7
MF:C11H16N4S
MW:236.336540222168
CID:308355
PubChem ID:95191
Update Time:2025-04-19
9H-Purine,6-(hexylthio)- Chemical and Physical Properties
Names and Identifiers
-
- 9H-Purine,6-(hexylthio)-
- 6-hexylsulfanyl-7H-purine
- 1H-Purine, 6-(hexylthio)-
- 6-(Hexylthio)-1H-purine
- 6-hexylmercapto-7(9)H-purine
- 6-Hexylmercaptopurine
- AC1L3TRO
- AC1Q4VZM
- AI3-26352
- SureCN8826229
- NSC22776
- 6-(Hexylthio)-9H-purine
- SCHEMBL8826229
- NS00030159
- 37109-78-7
- EINECS 253-352-4
- DTXSID90190606
- DPEYVWBFEYXFIT-UHFFFAOYSA-N
- NSC-22776
- NSC 22776
- 6-Hexylthio-9H-purine
- 1H-Purine (9CI), 6-(hexylthio)-
-
- Inchi： 1S/C11H16N4S/c1-2-3-4-5-6-16-11-9-10(13-7-12-9)14-8-15-11/h7-8H,2-6H2,1H3,(H,12,13,14,15)
- InChI Key： DPEYVWBFEYXFIT-UHFFFAOYSA-N
- SMILES： S(C1=C2C(=NC=N1)N=CN2)CCCCCC
Computed Properties
- Exact Mass: 236.10978
- Monoisotopic Mass: 236.10956770g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 16
- Rotatable Bond Count: 6
- Complexity: 202
- 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: 3
- Topological Polar Surface Area: 79.8?2
Experimental Properties
- PSA: 49.11
- LogP: 3.02530
9H-Purine,6-(hexylthio)- Related Literature
-
Jing Yu,Yu-Qi Lyu,Jiapeng Liu,Mohammed B. Effat,Junxiong Wu J. Mater. Chem. A, 2019,7, 17995-18002
-
Norihito Fukui,Keisuke Fujimoto,Hideki Yorimitsu,Atsuhiro Osuka Dalton Trans., 2017,46, 13322-13341
-
Xinhuan Wang,Shuangfei Cai,Cui Qi Analyst, 2017,142, 2500-2506
-
Abdelaziz Houmam,Emad M. Hamed Chem. Commun., 2012,48, 11328-11330
-
Ivor Lon?ari? Phys. Chem. Chem. Phys., 2015,17, 9436-9445
37109-78-7 (9H-Purine,6-(hexylthio)-) Related Products
- 5069-82-9(6-(Butylthio)-purine)
- 5443-88-9(6-(prop-2-en-1-ylsulfanyl)-9H-purine)
- 5417-84-5(6-Ethylmercaptopurine)
- 83277-80-9(6-n-Heptylmercaptopurine)
- 332062-08-5(Fmoc-S-3-amino-4,4-diphenyl-butyric acid)
- 1270529-38-8(1,2,3,4,5,6-Hexahydro-[2,3]bipyridinyl-6-ol)
- 2680771-01-9(4-cyclopentyl-3-{(prop-2-en-1-yloxy)carbonylamino}butanoic acid)
- 2098070-20-1(2-(3-(Pyridin-3-yl)-1H-pyrazol-1-yl)acetimidamide)
- 1444113-98-7(N-(3-cyanothiolan-3-yl)-2-[(2,2,2-trifluoroethyl)sulfanyl]pyridine-4-carboxamide)
- 941977-17-9(N'-(3-chloro-2-methylphenyl)-N-2-(dimethylamino)-2-(naphthalen-1-yl)ethylethanediamide)
Recommended suppliers
Hebei Liye chemical Co.,Ltd
Gold Member
Audited Supplier
CN Supplier
Bulk
Beyond Pharmaceutical Co., Ltd
Gold Member
Audited Supplier
CN Supplier
Reagent
ASIACHEM I&E (JIANGSU) CO., LTD
Gold Member
Audited Supplier
CN Supplier
Bulk
Shenzhen Jianxing Pharmaceutical Technology Co., Ltd.
Gold Member
Audited Supplier
CN Supplier
Reagent
Shanghai Hongxiang Biomedical Technology Co., Ltd.
Gold Member
Audited Supplier
CN Supplier
Bulk
