 Home > Encyclopedia > N-(5-butylsulfanyl-12,12-dimethyl-11-oxa-8-thia-4,6-diazatricyclo[7.4.0.02,7]trideca-1(9),2,4,6-tetraen-3-yl)-N',N'-diethylethane-1,2-diamine

N-(5-butylsulfanyl-12,12-dimethyl-11-oxa-8-thia-4,6-diazatricyclo[7.4.0.02,7]trideca-1(9),2,4,6-tetraen-3-yl)-N',N'-diethylethane-1,2-diamine

N-(5-butylsulfanyl-12,12-dimethyl-11-oxa-8-thia-4,6-diazatricyclo[7.4.0.02,7]trideca-1(9),2,4,6-tetraen-3-yl)-N',N'-diethylethane-1,2-diamine structure

CAS No:
847182-99-4
Formula:
C21H34N4OS2
Chemical Name:
N-(5-butylsulfanyl-12,12-dimethyl-11-oxa-8-thia-4,6-diazatricyclo[7.4.0.02,7]trideca-1(9),2,4,6-tetraen-3-yl)-N',N'-diethylethane-1,2-diamine
Synonyms:
ZINC2398416;STL345117;AKOS022106263;MCULE-6202013078;847182-99-4;N'-[2-(butylsulfanyl)-6,6-dimethyl-5,8-dihydro-6H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-yl]-N,N-diethylethane-1,2-diamine

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N-(5-butylsulfanyl-12,12-dimethyl-11-oxa-8-thia-4,6-diazatricyclo[7.4.0.02,7]trideca-1(9),2,4,6-tetraen-3-yl)-N',N'-diethylethane-1,2-diamine Basic Attributes

Molecular Weight：

422.7 g/mol

Exact Mass：

422.21740407 g/mol

Characteristics

PSA：

104 Å²

Computed Properties

Molecular Weight:422.7
XLogP3:5.1
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:10
Exact Mass:422.21740407
Monoisotopic Mass:422.21740407
Topological Polar Surface Area:104
Heavy Atom Count:28
Complexity:477
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of N-(5-butylsulfanyl-12,12-dimethyl-11-oxa-8-thia-4,6-diazatricyclo[7.4.0.02,7]trideca-1(9),2,4,6-tetraen-3-yl)-N',N'-diethylethane-1,2-diamine

Basic Attributes
Characteristics
Computed Properties

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