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139502-25-3 | 1H-Indazol-6-amine, 7-bromo-N-(4,5-dihydro-1H-imidazol-2-yl)-
CAS No: 139502-25-3 Catalog No: AG001B5C MDL No:
Product Description
Catalog Number:
AG001B5C
Chemical Name:
1H-Indazol-6-amine, 7-bromo-N-(4,5-dihydro-1H-imidazol-2-yl)-
CAS Number:
139502-25-3
Molecular Formula:
C10H10BrN5
Molecular Weight:
280.1239
IUPAC Name:
7-bromo-N-(4,5-dihydro-1H-imidazol-2-yl)-1H-indazol-6-amine
InChI:
InChI=1S/C10H10BrN5/c11-8-7(15-10-12-3-4-13-10)2-1-6-5-14-16-9(6)8/h1-2,5H,3-4H2,(H,14,16)(H2,12,13,15)
InChI Key:
SGCRPVAWFGYQAS-UHFFFAOYSA-N
SMILES:
Brc1c(ccc2c1[nH]nc2)NC1=NCCN1
Properties
Complexity:
295
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
279.012g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
280.129g/mol
Monoisotopic Mass:
279.012g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
65.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9
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