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7-benzyl-8-[2-(1-{4-nitrophenyl}ethylidene)hydrazino]-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione

7-benzyl-8-[2-(1-{4-nitrophenyl}ethylidene)hydrazino]-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione structure

CAS No:
329703-17-5
Formula:
C22H21N7O4
Chemical Name:
7-benzyl-8-[2-(1-{4-nitrophenyl}ethylidene)hydrazino]-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Synonyms:
STK537043;ZINC25782602;AKOS000576123;ST50226397;AG-690/10025015;SR-01000359745;SR-01000359745-1;7-benzyl-1,3-dimethyl-8-{(2Z)-2-[1-(4-nitrophenyl)ethylidene]hydrazinyl}-3,7-dihydro-1H-purine-2,6-dione;7-benzyl-8-[2-(1-{4-nitrophenyl}ethylidene)hydrazino]-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione;8-{[(1Z)-2-(4-nitrophenyl)-1-azaprop-1-enyl]amino}-1,3-dimethyl-7-benzyl-1,3,7 -trihydropurine-2,6-dione

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7-benzyl-8-[2-(1-{4-nitrophenyl}ethylidene)hydrazino]-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione Basic Attributes

Molecular Weight：

447.44664

Exact Mass：

447.166

Characteristics

PSA：

129

XLogP3：

3.2

Computed Properties

Molecular Weight:447.4
XLogP3:3.2
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:5
Exact Mass:447.16550218
Monoisotopic Mass:447.16550218
Topological Polar Surface Area:129
Heavy Atom Count:33
Complexity:786
Undefined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

Hot Searches: sodium valproate; cro3; sodium amytal; phosphate aluminum; 2 butanol; butyl acetate

Guide of 7-benzyl-8-[2-(1-{4-nitrophenyl}ethylidene)hydrazino]-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione

Basic Attributes
Characteristics
Computed Properties

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