COC1=CC=C(C=C1)C(C2=CC=CC=C2)(C3=CC=CC=C3)NC4=NC5=C(C(=O)N4)N=CN5C6C(C(C(O6)(CO)N=[N+]=[N-])O)F
CAS: 1365256-68-3
الاسم: 9-[(2R,3R,4R,5R)-5-azido-3-fluoro-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-2-[[(4-methoxyphenyl)-diphenylmethyl]amino]-1H-purin-6-one
SMILES: COC1=CC=C(C=C1)C(C2=CC=CC=C2)(C3=CC=CC=C3)NC4=NC5=C(C(=O)N4)N=CN5C6C(C(C(O6)(CO)N=[N+]=[N-])O)F

Molecular Processing

Molecular formula
C30H27FN8O5
Molecular weight
598.6
Exact mass
598.2088
XLogP
3.76
TPSA
183.28
H-bond donors
4
H-bond acceptors
9
Rotatable bonds
9
Heavy atoms
44
Rings
6
Aromatic rings
5
Saturated rings
1
Aliphatic rings
1
Stereo centers
4
Undefined stereo
4
Formal charge
0
Heteroatoms
14
Covalent units
1
Fraction Csp3
0.233
Molar refractivity
157.52

Supplementary Information

InChIKey: LEBZJRJPMWFAOE-UFGLGVGHSA-N
مرادفات
LEBZJRJPMWFAOE-UFGLGVGHSA-N4'-Azido-2'-fluoro-N2-(4-methoxytrityl)-2'-deoxyguanosine4'-C-Azido-2'-deoxy-2'-fluoro-N-[(4-methoxyphenyl)diphenylmethyl]guanosine1365256-68-3
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