 Home > Encyclopedia > 3-[7-(2-chlorophenyl)-3-thia-1,8,11,12-tetrazatricyclo[8.3.0.02,6]trideca-2(6),4,7,10,12-pentaen-4-yl]-1-morpholin-4-ylpropan-1-one

3-[7-(2-chlorophenyl)-3-thia-1,8,11,12-tetrazatricyclo[8.3.0.02,6]trideca-2(6),4,7,10,12-pentaen-4-yl]-1-morpholin-4-ylpropan-1-one

3-[7-(2-chlorophenyl)-3-thia-1,8,11,12-tetrazatricyclo[8.3.0.02,6]trideca-2(6),4,7,10,12-pentaen-4-yl]-1-morpholin-4-ylpropan-1-one structure

CAS No:
105219-69-0
Formula:
C21H20ClN5O2S
Chemical Name:
3-[7-(2-chlorophenyl)-3-thia-1,8,11,12-tetrazatricyclo[8.3.0.02,6]trideca-2(6),4,7,10,12-pentaen-4-yl]-1-morpholin-4-ylpropan-1-one
Synonyms:
WEB 2105;WEB-2105;Web 2105;105219-69-0;Morpholine, 4-(3-(4-(2-chlorophenyl)-6H-thieno(3,2-f)(1,2,4)triazolo(4,3-a)(1,4)diazepin-2-yl)-1-oxopropyl)-;DTXSID90147014;WEB-2105;4-(3-(4-(2-chlorophenyl)-6H-thieno(3,2-f)(1,2,4)triazolo(4,3-a)(1,4)diazepin-2-yl)-1-oxopropyl)-Morpholine

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3-[7-(2-chlorophenyl)-3-thia-1,8,11,12-tetrazatricyclo[8.3.0.02,6]trideca-2(6),4,7,10,12-pentaen-4-yl]-1-morpholin-4-ylpropan-1-one Basic Attributes

Molecular Weight：

441.9 g/mol

Exact Mass：

441.1026238 g/mol

DSSTox ID：

DTXSID90147014

Characteristics

PSA：

101 Å²

Drug Information

MeSH Entry Terms：

WEB 2105

Computed Properties

Molecular Weight:441.9
XLogP3:2.2
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:4
Exact Mass:441.1026238
Monoisotopic Mass:441.1026238
Topological Polar Surface Area:101
Heavy Atom Count:30
Complexity:661
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 3-[7-(2-chlorophenyl)-3-thia-1,8,11,12-tetrazatricyclo[8.3.0.02,6]trideca-2(6),4,7,10,12-pentaen-4-yl]-1-morpholin-4-ylpropan-1-one

Basic Attributes
Characteristics
Drug Information
Computed Properties

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