 Home > Encyclopedia > 3-benzyl-1-[2-[6-[(1,3-dimethyl-2,4,6-trioxo-1,3-diazinan-5-ylidene)methyl]-7-methoxy-1,3-benzodioxol-5-yl]ethyl]-1-methylthiourea

3-benzyl-1-[2-[6-[(1,3-dimethyl-2,4,6-trioxo-1,3-diazinan-5-ylidene)methyl]-7-methoxy-1,3-benzodioxol-5-yl]ethyl]-1-methylthiourea

3-benzyl-1-[2-[6-[(1,3-dimethyl-2,4,6-trioxo-1,3-diazinan-5-ylidene)methyl]-7-methoxy-1,3-benzodioxol-5-yl]ethyl]-1-methylthiourea structure

CAS No:
575462-08-7
Formula:
C26H28N4O6S
Chemical Name:
3-benzyl-1-[2-[6-[(1,3-dimethyl-2,4,6-trioxo-1,3-diazinan-5-ylidene)methyl]-7-methoxy-1,3-benzodioxol-5-yl]ethyl]-1-methylthiourea
Synonyms:
ZINC2376996;STK557644;AKOS005483787;MCULE-1808697889;3-benzyl-1-(2-{6-[(1,3-dimethyl-2,4,6-trioxotetrahydropyrimidin-5(2H)-ylidene)methyl]-7-methoxy-1,3-benzodioxol-5-yl}ethyl)-1-methylthiourea;575462-08-7

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3-benzyl-1-[2-[6-[(1,3-dimethyl-2,4,6-trioxo-1,3-diazinan-5-ylidene)methyl]-7-methoxy-1,3-benzodioxol-5-yl]ethyl]-1-methylthiourea Basic Attributes

Molecular Weight：

524.6 g/mol

Exact Mass：

524.17295580 g/mol

Characteristics

PSA：

133 Å²

Computed Properties

Molecular Weight:524.6
XLogP3:2.8
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:7
Exact Mass:524.17295580
Monoisotopic Mass:524.17295580
Topological Polar Surface Area:133
Heavy Atom Count:37
Complexity:897
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 3-benzyl-1-[2-[6-[(1,3-dimethyl-2,4,6-trioxo-1,3-diazinan-5-ylidene)methyl]-7-methoxy-1,3-benzodioxol-5-yl]ethyl]-1-methylthiourea

Basic Attributes
Characteristics
Computed Properties

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