N-[(6-amino-1-benzyl-2,4-dioxopyrimidin-5-yl)-butylcarbamothioyl]thiophene-2-carboxamide
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N-[(6-amino-1-benzyl-2,4-dioxopyrimidin-5-yl)-butylcarbamothioyl]thiophene-2-carboxamide
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CAS No:
732270-59-6
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Formula:
C21H23N5O3S2
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Chemical Name:
N-[(6-amino-1-benzyl-2,4-dioxopyrimidin-5-yl)-butylcarbamothioyl]thiophene-2-carboxamide
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Synonyms:
ZINC3306043;AKOS034464795;MCULE-9535548365;Z56903394;1-(6-amino-1-benzyl-2,4-dioxo-1,2,3,4-tetrahydropyrimidin-5-yl)-1-butyl-3-(thiophene-2-carbonyl)thiourea;732270-59-6
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CAS No:
N-[(6-amino-1-benzyl-2,4-dioxopyrimidin-5-yl)-butylcarbamothioyl]thiophene-2-carboxamide Basic Attributes
457.6 g/mol
457.12423196 g/mol
Computed Properties
Molecular Weight:457.6
XLogP3:2.9
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:7
Exact Mass:457.12423196
Monoisotopic Mass:457.12423196
Topological Polar Surface Area:168
Heavy Atom Count:31
Complexity:751
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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