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10184-19-7 | 3H-Purin-6-amine, 3-(diphenylmethyl)-
CAS No: 10184-19-7 Catalog No: AG0005P7 MDL No:
Product Description
Catalog Number:
AG0005P7
Chemical Name:
3H-Purin-6-amine, 3-(diphenylmethyl)-
CAS Number:
10184-19-7
Molecular Formula:
C18H15N5
Molecular Weight:
301.3452
IUPAC Name:
3-benzhydryl-7H-purin-6-imine
InChI:
InChI=1S/C18H15N5/c19-17-15-18(21-11-20-15)23(12-22-17)16(13-7-3-1-4-8-13)14-9-5-2-6-10-14/h1-12,16,19H,(H,20,21)
InChI Key:
PVRRHHOKIPJJKU-UHFFFAOYSA-N
SMILES:
Nc1ncn(c2c1ncn2)C(c1ccccc1)c1ccccc1
NSC Number:
76925
Properties
Complexity:
432
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
301.133g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
301.353g/mol
Monoisotopic Mass:
301.133g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
68.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3
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