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dimethyl 5-[[amino-(diaminomethylideneamino)methylidene]amino]benzene-1,3-dicarboxylate

dimethyl 5-[[amino-(diaminomethylideneamino)methylidene]amino]benzene-1,3-dicarboxylate structure

CAS No:
524055-72-9
Formula:
C12H15N5O4
Chemical Name:
dimethyl 5-[[amino-(diaminomethylideneamino)methylidene]amino]benzene-1,3-dicarboxylate
Synonyms:
524055-72-9;dimethyl 5-{[{[amino(imino)methyl]amino}-(imino)methyl]amino}isophthalate;Dimethyl 5-[[amino-(diaminomethylideneamino)methylidene]amino]benzene-1,3-dicarboxylate;Dimethyl 5-([([amino(imino)methyl]amino)(imino)methyl]amino)isophthalate;Dimethyl 5-(3-carbamimidoylguanidino)isophthalate;dimethyl 5-{[{[amino(imino)methyl]amino}(imino)methyl]amino}isophthalate;MLS000332861;CHEMBL1461867;3,5-dicarbomethoxyphenylbiguanide;HMS2785L18;ALBB-022027;MFCD03615413;STK131212;ZINC18169298;AKOS002224885;MCULE-1355741927;LS-06774;SMR000436244;R7775;ST50106277;dimethyl 5-(N'-carbamimidoylcarbamimidamido)benzene-1,3-dicarboxylate;methyl 5-{[(amidinoamino)iminomethyl]amino}-3-(methoxycarbonyl)benzoate;1,3-DIMETHYL 5-[(CARBAMIMIDAMIDOMETHANIMIDOYL)AMINO]BENZENE-1,3-DICARBOXYLATE;1,3-benzenedicarboxylic acid, 5-[[[(aminoiminomethyl)amino]iminomethyl]amino]-, dimethyl ester

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dimethyl 5-[[amino-(diaminomethylideneamino)methylidene]amino]benzene-1,3-dicarboxylate Basic Attributes

Molecular Weight：

293.28 g/mol

Exact Mass：

293.11240398 g/mol

Characteristics

PSA：

155 Å²

Water Solubility：

>44 [ug/mL]

Computed Properties

Molecular Weight:293.28
XLogP3:-0.4
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:6
Exact Mass:293.11240398
Monoisotopic Mass:293.11240398
Topological Polar Surface Area:155
Heavy Atom Count:21
Complexity:435
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of dimethyl 5-[[amino-(diaminomethylideneamino)methylidene]amino]benzene-1,3-dicarboxylate

Basic Attributes
Characteristics
Computed Properties
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