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

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

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

CAS No:
850243-27-5
Formula:
C21H29N5OS
Chemical Name:
5-(3,5-dimethylpyrazol-1-yl)-12,12-dimethyl-N-pentyl-11-oxa-8-thia-4,6-diazatricyclo[7.4.0.02,7]trideca-1(9),2,4,6-tetraen-3-amine
Synonyms:
ZINC2380831;STL238799;AKOS025277733;MCULE-4528918696;2-(3,5-dimethyl-1H-pyrazol-1-yl)-6,6-dimethyl-N-pentyl-5,8-dihydro-6H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-amine;850243-27-5

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5-(3,5-dimethylpyrazol-1-yl)-12,12-dimethyl-N-pentyl-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：

399.20928174 g/mol

Characteristics

PSA：

93.1 Å²

Computed Properties

Molecular Weight:399.6
XLogP3:5.1
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:6
Exact Mass:399.20928174
Monoisotopic Mass:399.20928174
Topological Polar Surface Area:93.1
Heavy Atom Count:28
Complexity:535
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 5-(3,5-dimethylpyrazol-1-yl)-12,12-dimethyl-N-pentyl-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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