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2-imino-5-(indol-3-ylidenemethyl)-1,3-dimethylimidazol-4-ol

2-imino-5-(indol-3-ylidenemethyl)-1,3-dimethylimidazol-4-ol structure

CAS No:
63153-56-0
Formula:
C14H14N4O
Chemical Name:
2-imino-5-(indol-3-ylidenemethyl)-1,3-dimethylimidazol-4-ol
Synonyms:
aplysinopsin;63153-56-0;(E)-5-[(3-Indolyl)methylene]-2-imino-1,3-dimethyl-4-imidazolidinone;MFCD07711986;SY237679;2-Imino-5-(indol-3-ylidenemethyl)-1,3-dimethylimidazol-4-ol;N1C=C(C2=CC=CC=C12)C=C1C(N(/C(/N1C)=N/[H])C)=O;N1C=C(C2=CC=CC=C12)C=C1C(N(\C(\N1C)=N/[H])C)=O;(5E)-2-imino-5-(1H-indol-3-ylmethylidene)-1,3-dimethylimidazolidin-4-one;(E)-5-(indol-3-ylmethylene)-1,3-dimethyl-2-imino-4-imidazolidinone;2-imino-5-(1H-indol-3-ylmethylidene)-1,3-dimethylimidazolidin-4-one

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2-imino-5-(indol-3-ylidenemethyl)-1,3-dimethylimidazol-4-ol Basic Attributes

Molecular Weight：

254.29 g/mol

Exact Mass：

254.11676108 g/mol

Characteristics

PSA：

62.9 Å²

XLogP3：

1.8229

Melting Point：

245 - 247 °C (water)

Drug Information

MeSH Entry Terms：

aplysinopsin

Computed Properties

Molecular Weight:254.29
XLogP3:0.7
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:1
Exact Mass:254.11676108
Monoisotopic Mass:254.11676108
Topological Polar Surface Area:62.9
Heavy Atom Count:19
Complexity:506
Undefined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 2-imino-5-(indol-3-ylidenemethyl)-1,3-dimethylimidazol-4-ol

Basic Attributes
Characteristics
Drug Information
Computed Properties

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