Cas no 59549-50-7 (Pyrimidine, 5-bromo-4-methoxy-2-(1-piperidinyl)-)
59549-50-7 structure
Product Name:Pyrimidine, 5-bromo-4-methoxy-2-(1-piperidinyl)-
CAS No:59549-50-7
MF:C10H14BrN3O
MW:272.141661167145
CID:338316
PubChem ID:12264795
Update Time:2025-04-19
Pyrimidine, 5-bromo-4-methoxy-2-(1-piperidinyl)- Chemical and Physical Properties
Names and Identifiers
-
- Pyrimidine, 5-bromo-4-methoxy-2-(1-piperidinyl)-
- 5-bromo-4-methoxy-2-piperidin-1-ylpyrimidine
- DTXSID20483073
- 59549-50-7
-
- Inchi： 1S/C10H14BrN3O/c1-15-9-8(11)7-12-10(13-9)14-5-3-2-4-6-14/h7H,2-6H2,1H3
- InChI Key： JNFXFAHBOCXPRH-UHFFFAOYSA-N
- SMILES： BrC1C=NC(=NC=1OC)N1CCCCC1
Computed Properties
- Exact Mass: 271.03212
- Monoisotopic Mass: 271.03202g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 15
- Rotatable Bond Count: 2
- Complexity: 199
- 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: 2.5
- Topological Polar Surface Area: 38.2?2
Experimental Properties
- PSA: 38.25
Pyrimidine, 5-bromo-4-methoxy-2-(1-piperidinyl)- Related Literature
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Karl Crowley,Eimer O'Malley,Aoife Morrin,Malcolm R. Smyth,Anthony J. Killard Analyst, 2008,133, 391-399
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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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Luis Miguel Azofra,Douglas R. MacFarlane,Chenghua Sun Chem. Commun., 2016,52, 3548-3551
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Bidyut Kumar Kundu,Rinky Singh,Ritudhwaj Tiwari,Debasis Nayak New J. Chem., 2019,43, 4867-4877
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Doug Ogrin,Laura H. van Poppel,Simon G. Bott,Andrew R. Barron Dalton Trans., 2004, 3689-3694
59549-50-7 (Pyrimidine, 5-bromo-4-methoxy-2-(1-piperidinyl)-) Related Products
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