 Home > Encyclopedia > 1-benzyl-3-[(12,12-dimethyl-11-oxa-8-thia-4,6-diazatricyclo[7.4.0.02,7]trideca-1(9),2,4,6-tetraen-3-yl)amino]thiourea

1-benzyl-3-[(12,12-dimethyl-11-oxa-8-thia-4,6-diazatricyclo[7.4.0.02,7]trideca-1(9),2,4,6-tetraen-3-yl)amino]thiourea

1-benzyl-3-[(12,12-dimethyl-11-oxa-8-thia-4,6-diazatricyclo[7.4.0.02,7]trideca-1(9),2,4,6-tetraen-3-yl)amino]thiourea structure

CAS No:
351341-44-1
Formula:
C19H21N5OS2
Chemical Name:
1-benzyl-3-[(12,12-dimethyl-11-oxa-8-thia-4,6-diazatricyclo[7.4.0.02,7]trideca-1(9),2,4,6-tetraen-3-yl)amino]thiourea
Synonyms:
SMR000211340;MLS000587334;CHEMBL1302836;HMS2612D19;ZINC8691072;STK097411;AKOS003593245;MCULE-3641304852;351341-44-1;N-benzyl-2-(6,6-dimethyl-5,8-dihydro-6H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-yl)hydrazinecarbothioamide

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1-benzyl-3-[(12,12-dimethyl-11-oxa-8-thia-4,6-diazatricyclo[7.4.0.02,7]trideca-1(9),2,4,6-tetraen-3-yl)amino]thiourea Basic Attributes

Molecular Weight：

399.5 g/mol

Exact Mass：

399.11875266 g/mol

Characteristics

PSA：

131 Å²

Computed Properties

Molecular Weight:399.5
XLogP3:3.6
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:4
Exact Mass:399.11875266
Monoisotopic Mass:399.11875266
Topological Polar Surface Area:131
Heavy Atom Count:27
Complexity:528
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 1-benzyl-3-[(12,12-dimethyl-11-oxa-8-thia-4,6-diazatricyclo[7.4.0.02,7]trideca-1(9),2,4,6-tetraen-3-yl)amino]thiourea

Basic Attributes
Characteristics
Computed Properties

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