 Home > Encyclopedia > 5-ethylsulfanyl-12,12-dimethyl-N-(2-phenylethyl)-11-oxa-8-thia-4,6-diazatricyclo[7.4.0.02,7]trideca-1(9),2,4,6-tetraen-3-amine

5-ethylsulfanyl-12,12-dimethyl-N-(2-phenylethyl)-11-oxa-8-thia-4,6-diazatricyclo[7.4.0.02,7]trideca-1(9),2,4,6-tetraen-3-amine

5-ethylsulfanyl-12,12-dimethyl-N-(2-phenylethyl)-11-oxa-8-thia-4,6-diazatricyclo[7.4.0.02,7]trideca-1(9),2,4,6-tetraen-3-amine structure

CAS No:
844664-00-2
Formula:
C21H25N3OS2
Chemical Name:
5-ethylsulfanyl-12,12-dimethyl-N-(2-phenylethyl)-11-oxa-8-thia-4,6-diazatricyclo[7.4.0.02,7]trideca-1(9),2,4,6-tetraen-3-amine
Synonyms:
ZINC2405454;STL342948;AKOS022109051;MCULE-6427562728;2-(ethylsulfanyl)-6,6-dimethyl-N-(2-phenylethyl)-5,8-dihydro-6H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-amine;844664-00-2

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5-ethylsulfanyl-12,12-dimethyl-N-(2-phenylethyl)-11-oxa-8-thia-4,6-diazatricyclo[7.4.0.02,7]trideca-1(9),2,4,6-tetraen-3-amine Basic Attributes

Molecular Weight：

399.6 g/mol

Exact Mass：

399.14390478 g/mol

Characteristics

PSA：

101 Å²

Computed Properties

Molecular Weight:399.6
XLogP3:5.4
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:6
Exact Mass:399.14390478
Monoisotopic Mass:399.14390478
Topological Polar Surface Area:101
Heavy Atom Count:27
Complexity:486
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 5-ethylsulfanyl-12,12-dimethyl-N-(2-phenylethyl)-11-oxa-8-thia-4,6-diazatricyclo[7.4.0.02,7]trideca-1(9),2,4,6-tetraen-3-amine

Basic Attributes
Characteristics
Computed Properties

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