 Home > Encyclopedia > 2-[(4-chlorophenyl)methylsulfanyl]-3-(2-methylprop-2-enyl)-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-one

2-[(4-chlorophenyl)methylsulfanyl]-3-(2-methylprop-2-enyl)-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-one

2-[(4-chlorophenyl)methylsulfanyl]-3-(2-methylprop-2-enyl)-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-one structure

CAS No:
328069-23-4
Formula:
C21H21ClN2OS2
Chemical Name:
2-[(4-chlorophenyl)methylsulfanyl]-3-(2-methylprop-2-enyl)-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-one
Synonyms:
Oprea1_290791;Oprea1_765444;ZINC2208093;STK700778;AKOS005607614;MCULE-2300168429;2-[(4-chlorobenzyl)sulfanyl]-3-(2-methylprop-2-en-1-yl)-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one;328069-23-4

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2-[(4-chlorophenyl)methylsulfanyl]-3-(2-methylprop-2-enyl)-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-one Basic Attributes

Molecular Weight：

417.0 g/mol

Exact Mass：

416.0783833 g/mol

Characteristics

PSA：

86.2 Å²

Computed Properties

Molecular Weight:417.0
XLogP3:6.5
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:5
Exact Mass:416.0783833
Monoisotopic Mass:416.0783833
Topological Polar Surface Area:86.2
Heavy Atom Count:27
Complexity:617
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 2-[(4-chlorophenyl)methylsulfanyl]-3-(2-methylprop-2-enyl)-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-one

Basic Attributes
Characteristics
Computed Properties

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