 Home > Encyclopedia > 3-heptylsulfanyl-7,12,12-trimethyl-13-oxa-16-thia-2,4,5,7-tetrazatetracyclo[7.7.0.02,6.010,15]hexadeca-1(9),3,5,10(15)-tetraen-8-one

3-heptylsulfanyl-7,12,12-trimethyl-13-oxa-16-thia-2,4,5,7-tetrazatetracyclo[7.7.0.02,6.010,15]hexadeca-1(9),3,5,10(15)-tetraen-8-one

3-heptylsulfanyl-7,12,12-trimethyl-13-oxa-16-thia-2,4,5,7-tetrazatetracyclo[7.7.0.02,6.010,15]hexadeca-1(9),3,5,10(15)-tetraen-8-one structure

CAS No:
372498-71-0
Formula:
C20H28N4O2S2
Chemical Name:
3-heptylsulfanyl-7,12,12-trimethyl-13-oxa-16-thia-2,4,5,7-tetrazatetracyclo[7.7.0.02,6.010,15]hexadeca-1(9),3,5,10(15)-tetraen-8-one
Synonyms:
ZINC1788582;STK525052;AKOS005458944;MCULE-2129664189;1-(heptylsulfanyl)-4,7,7-trimethyl-6,9-dihydro-7H-pyrano[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one;372498-71-0

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3-heptylsulfanyl-7,12,12-trimethyl-13-oxa-16-thia-2,4,5,7-tetrazatetracyclo[7.7.0.02,6.010,15]hexadeca-1(9),3,5,10(15)-tetraen-8-one Basic Attributes

Molecular Weight：

420.6 g/mol

Exact Mass：

420.16536850 g/mol

Characteristics

PSA：

114 Å²

Computed Properties

Molecular Weight:420.6
XLogP3:4.6
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:7
Exact Mass:420.16536850
Monoisotopic Mass:420.16536850
Topological Polar Surface Area:114
Heavy Atom Count:28
Complexity:578
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 3-heptylsulfanyl-7,12,12-trimethyl-13-oxa-16-thia-2,4,5,7-tetrazatetracyclo[7.7.0.02,6.010,15]hexadeca-1(9),3,5,10(15)-tetraen-8-one

Basic Attributes
Characteristics
Computed Properties

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