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1-[3-(6-aminopurin-9-yl)propyl]pyridin-1-ium-3-carboxamide;bromide;trihydrate

1-[3-(6-aminopurin-9-yl)propyl]pyridin-1-ium-3-carboxamide;bromide;trihydrate structure

CAS No:
50359-76-7
Formula:
C14H22BrN7O4
Chemical Name:
1-[3-(6-aminopurin-9-yl)propyl]pyridin-1-ium-3-carboxamide;bromide;trihydrate
Synonyms:
N-(3-(aden-9-yl)propyl)-3-carbamoylpyridinium bromide;50359-76-7;N-(3-(Aden-9-yl)propyl)-3-carbamoylpyridinium bromide;Pyridinium, 3-(aminocarbonyl)-1-(3-(6-amino-9H-purin-9-yl)propyl)-, bromide, trihydrate

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1-[3-(6-aminopurin-9-yl)propyl]pyridin-1-ium-3-carboxamide;bromide;trihydrate Basic Attributes

Molecular Weight：

432.27 g/mol

Exact Mass：

431.09166 g/mol

Characteristics

PSA：

120 Å²

Drug Information

MeSH Entry Terms：

N-(3-(aden-9-yl)propyl)-3-carbamoylpyridinium bromide

Computed Properties

Molecular Weight:432.27
Hydrogen Bond Donor Count:5
Hydrogen Bond Acceptor Count:9
Rotatable Bond Count:5
Exact Mass:431.09166
Monoisotopic Mass:431.09166
Topological Polar Surface Area:120
Heavy Atom Count:26
Complexity:393
Covalently-Bonded Unit Count:5
Compound Is Canonicalized:Yes

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Guide of 1-[3-(6-aminopurin-9-yl)propyl]pyridin-1-ium-3-carboxamide;bromide;trihydrate

Basic Attributes
Characteristics
Drug Information
Computed Properties

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