 Home > Encyclopedia > 4-benzyl-5-[(3,4-dichlorophenyl)methylsulfanyl]-8-thia-4,6-diazatricyclo[7.5.0.02,7]tetradeca-1(9),2(7),5-trien-3-one

4-benzyl-5-[(3,4-dichlorophenyl)methylsulfanyl]-8-thia-4,6-diazatricyclo[7.5.0.02,7]tetradeca-1(9),2(7),5-trien-3-one

4-benzyl-5-[(3,4-dichlorophenyl)methylsulfanyl]-8-thia-4,6-diazatricyclo[7.5.0.02,7]tetradeca-1(9),2(7),5-trien-3-one structure

CAS No:
372083-83-5
Formula:
C25H22Cl2N2OS2
Chemical Name:
4-benzyl-5-[(3,4-dichlorophenyl)methylsulfanyl]-8-thia-4,6-diazatricyclo[7.5.0.02,7]tetradeca-1(9),2(7),5-trien-3-one
Synonyms:
C25H22Cl2N2OS2;ZINC2271714;STL325780;AKOS022137792;MCULE-3313084823;3-benzyl-2-[(3,4-dichlorobenzyl)sulfanyl]-3,5,6,7,8,9-hexahydro-4H-cyclohepta[4,5]thieno[2,3-d]pyrimidin-4-one;372083-83-5

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4-benzyl-5-[(3,4-dichlorophenyl)methylsulfanyl]-8-thia-4,6-diazatricyclo[7.5.0.02,7]tetradeca-1(9),2(7),5-trien-3-one Basic Attributes

Molecular Weight：

501.5 g/mol

Exact Mass：

500.0550611 g/mol

Characteristics

PSA：

86.2 Å²

Computed Properties

Molecular Weight:501.5
XLogP3:7.8
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:5
Exact Mass:500.0550611
Monoisotopic Mass:500.0550611
Topological Polar Surface Area:86.2
Heavy Atom Count:32
Complexity:701
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 4-benzyl-5-[(3,4-dichlorophenyl)methylsulfanyl]-8-thia-4,6-diazatricyclo[7.5.0.02,7]tetradeca-1(9),2(7),5-trien-3-one

Basic Attributes
Characteristics
Computed Properties

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