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26035-92-7

26035-92-7 | 7H-Pyrrolo[2,3-d]pyrimidine, 4-chloro-6-methyl-7-[(tetrahydro-2-furanyl)methyl]-

CAS No: 26035-92-7 Catalog No: AG002RFJ MDL No:

Product Description

Catalog Number:
AG002RFJ
Chemical Name:
7H-Pyrrolo[2,3-d]pyrimidine, 4-chloro-6-methyl-7-[(tetrahydro-2-furanyl)methyl]-
CAS Number:
26035-92-7
Molecular Formula:
C12H14ClN3O
Molecular Weight:
251.7121
IUPAC Name:
4-chloro-6-methyl-7-(oxolan-2-ylmethyl)pyrrolo[2,3-d]pyrimidine
InChI:
InChI=1S/C12H14ClN3O/c1-8-5-10-11(13)14-7-15-12(10)16(8)6-9-3-2-4-17-9/h5,7,9H,2-4,6H2,1H3
InChI Key:
ZQWPROZLWBVXHC-UHFFFAOYSA-N
SMILES:
Clc1ncnc2c1cc(n2CC1CCCO1)C

Properties

Complexity:
279  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
251.083g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
251.714g/mol
Monoisotopic Mass:
251.083g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
39.9A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3  

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