 Home > Encyclopedia > (6Z)-3-benzylsulfanyl-6-[(5-chloro-2-prop-2-enoxyphenyl)methylidene]-5-imino-[1,2,4]thiadiazolo[4,5-a]pyrimidin-7-one

(6Z)-3-benzylsulfanyl-6-[(5-chloro-2-prop-2-enoxyphenyl)methylidene]-5-imino-[1,2,4]thiadiazolo[4,5-a]pyrimidin-7-one

(6Z)-3-benzylsulfanyl-6-[(5-chloro-2-prop-2-enoxyphenyl)methylidene]-5-imino-[1,2,4]thiadiazolo[4,5-a]pyrimidin-7-one structure

CAS No:
578701-12-9
Formula:
C22H17ClN4O2S2
Chemical Name:
(6Z)-3-benzylsulfanyl-6-[(5-chloro-2-prop-2-enoxyphenyl)methylidene]-5-imino-[1,2,4]thiadiazolo[4,5-a]pyrimidin-7-one
Synonyms:
STK712473;ZINC13750086;AKOS005523577;(6Z)-3-(benzylsulfanyl)-6-[5-chloro-2-(prop-2-en-1-yloxy)benzylidene]-5-imino-5,6-dihydro-7H-[1,2,4]thiadiazolo[4,5-a]pyrimidin-7-one;578701-12-9

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(6Z)-3-benzylsulfanyl-6-[(5-chloro-2-prop-2-enoxyphenyl)methylidene]-5-imino-[1,2,4]thiadiazolo[4,5-a]pyrimidin-7-one Basic Attributes

Molecular Weight：

469.0 g/mol

Exact Mass：

468.0481458 g/mol

Characteristics

PSA：

129 Å²

Computed Properties

Molecular Weight:469.0
XLogP3:5.5
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:7
Exact Mass:468.0481458
Monoisotopic Mass:468.0481458
Topological Polar Surface Area:129
Heavy Atom Count:31
Complexity:822
Defined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of (6Z)-3-benzylsulfanyl-6-[(5-chloro-2-prop-2-enoxyphenyl)methylidene]-5-imino-[1,2,4]thiadiazolo[4,5-a]pyrimidin-7-one

Basic Attributes
Characteristics
Computed Properties

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