 Home > Encyclopedia > (6Z)-2-benzylsulfanyl-6-[[1-[(4-chlorophenyl)methyl]indol-3-yl]methylidene]-5-imino-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one

(6Z)-2-benzylsulfanyl-6-[[1-[(4-chlorophenyl)methyl]indol-3-yl]methylidene]-5-imino-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one

(6Z)-2-benzylsulfanyl-6-[[1-[(4-chlorophenyl)methyl]indol-3-yl]methylidene]-5-imino-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one structure

CAS No:
843630-80-8
Formula:
C28H20ClN5OS2
Chemical Name:
(6Z)-2-benzylsulfanyl-6-[[1-[(4-chlorophenyl)methyl]indol-3-yl]methylidene]-5-imino-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Synonyms:
C28H20ClN5OS2;ZINC2422282;STK555995;AKOS005482025;(6Z)-2-(benzylsulfanyl)-6-{[1-(4-chlorobenzyl)-1H-indol-3-yl]methylidene}-5-imino-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one;843630-80-8

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(6Z)-2-benzylsulfanyl-6-[[1-[(4-chlorophenyl)methyl]indol-3-yl]methylidene]-5-imino-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one Basic Attributes

Molecular Weight：

542.1 g/mol

Exact Mass：

541.0797803 g/mol

Characteristics

PSA：

124 Å²

Computed Properties

Molecular Weight:542.1
XLogP3:7
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:6
Exact Mass:541.0797803
Monoisotopic Mass:541.0797803
Topological Polar Surface Area:124
Heavy Atom Count:37
Complexity:985
Defined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of (6Z)-2-benzylsulfanyl-6-[[1-[(4-chlorophenyl)methyl]indol-3-yl]methylidene]-5-imino-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one

Basic Attributes
Characteristics
Computed Properties

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