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1-[2-(cyclohexen-1-yl)ethyl]-6-hydroxy-5-(2-hydroxyethyliminomethyl)-2-sulfanylidenepyrimidin-4-one

1-[2-(cyclohexen-1-yl)ethyl]-6-hydroxy-5-(2-hydroxyethyliminomethyl)-2-sulfanylidenepyrimidin-4-one structure

CAS No:
714234-64-7
Formula:
C15H21N3O3S
Chemical Name:
1-[2-(cyclohexen-1-yl)ethyl]-6-hydroxy-5-(2-hydroxyethyliminomethyl)-2-sulfanylidenepyrimidin-4-one
Synonyms:
CHEMBL3787153;ZINC5829797;BDBM50161821;STL041061;AKOS005694797;AKOS032384416;MCULE-7138129225;(5Z)-1-[2-(cyclohex-1-en-1-yl)ethyl]-5-{[(2-hydroxyethyl)amino]methylidene}-2-sulfanylpyrimidine-4,6(1H,5H)-dione;(5Z)-1-[2-(cyclohexen-1-yl)ethyl]-5-[(2-hydroxyethylamino)methylene]-2-thioxo-hexahydropyrimidine-4,6-dione;714234-64-7

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1-[2-(cyclohexen-1-yl)ethyl]-6-hydroxy-5-(2-hydroxyethyliminomethyl)-2-sulfanylidenepyrimidin-4-one Basic Attributes

Molecular Weight：

323.4 g/mol

Exact Mass：

323.13036271 g/mol

Characteristics

PSA：

117 Å²

Computed Properties

Molecular Weight:323.4
XLogP3:0.8
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:6
Exact Mass:323.13036271
Monoisotopic Mass:323.13036271
Topological Polar Surface Area:117
Heavy Atom Count:22
Complexity:540
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 1-[2-(cyclohexen-1-yl)ethyl]-6-hydroxy-5-(2-hydroxyethyliminomethyl)-2-sulfanylidenepyrimidin-4-one

Basic Attributes
Characteristics
Computed Properties

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