Home Other Building Blocks 6-[(3-methoxyphenyl)methyl]-4-methyl-5H,6H-[1,2]diazolo[3,4-c]pyrazol-3-amine

6-[(3-methoxyphenyl)methyl]-4-methyl-5H,6H-[1,2]diazolo[3,4-c]pyrazol-3-amine

CAS No.:
1280804-28-5
Catalog Number:
AG01AH5I
Molecular Formula:
C13H15N5O
Molecular Weight:
257.2911
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Product Description
Catalog Number:
AG01AH5I
Chemical Name:
6-[(3-methoxyphenyl)methyl]-4-methyl-5H,6H-[1,2]diazolo[3,4-c]pyrazol-3-amine
CAS Number:
1280804-28-5
Molecular Formula:
C13H15N5O
Molecular Weight:
257.2911
MDL Number:
MFCD26143721
IUPAC Name:
6-[(3-methoxyphenyl)methyl]-4-methyl-2H-pyrazolo[3,4-c]pyrazol-3-amine
InChI:
InChI=1S/C13H15N5O/c1-8-11-12(14)15-16-13(11)18(17-8)7-9-4-3-5-10(6-9)19-2/h3-6H,7H2,1-2H3,(H3,14,15,16)
InChI Key:
NPUIXYSSORHFNL-UHFFFAOYSA-N
SMILES:
COc1cccc(c1)Cn1[nH]c(c2c1nnc2N)C
Properties
Complexity:
315  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
257.128g/mol
Formal Charge:
0
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
257.297g/mol
Monoisotopic Mass:
257.128g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
81.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8  
Properties