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1-[[2-[[5-(4-tert-butylphenyl)-4-(4-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]acetyl]amino]-3-(4-methylphenyl)thiourea

1-[[2-[[5-(4-tert-butylphenyl)-4-(4-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]acetyl]amino]-3-(4-methylphenyl)thiourea structure

CAS No:
488137-63-9
Formula:
C29H32N6OS2
Chemical Name:
1-[[2-[[5-(4-tert-butylphenyl)-4-(4-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]acetyl]amino]-3-(4-methylphenyl)thiourea
Synonyms:
C29H32N6OS2;ZINC1770083;STL037535;AKOS005691252;MCULE-9958212900;ST50421543;2-({[5-(4-tert-butylphenyl)-4-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)-N-(4-methylphenyl)hydrazinecarbothioamide;2-{5-[4-(tert-butyl)phenyl]-4-(4-methylphenyl)(1,2,4-triazol-3-ylthio)}-N-({[( 4-methylphenyl)amino]thioxomethyl}amino)acetamide;488137-63-9

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1-[[2-[[5-(4-tert-butylphenyl)-4-(4-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]acetyl]amino]-3-(4-methylphenyl)thiourea Basic Attributes

Molecular Weight：

544.7 g/mol

Exact Mass：

544.20790201 g/mol

Characteristics

PSA：

141 Å²

Computed Properties

Molecular Weight:544.7
XLogP3:6.8
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:7
Exact Mass:544.20790201
Monoisotopic Mass:544.20790201
Topological Polar Surface Area:141
Heavy Atom Count:38
Complexity:768
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 1-[[2-[[5-(4-tert-butylphenyl)-4-(4-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]acetyl]amino]-3-(4-methylphenyl)thiourea

Basic Attributes
Characteristics
Computed Properties

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