propan-2-yl 2-[(5-amino-1H-1,2,4-triazol-3-yl)sulfanyl]acetate
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propan-2-yl 2-[(5-amino-1H-1,2,4-triazol-3-yl)sulfanyl]acetate
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CAS No:
496033-64-8
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Formula:
C7H12N4O2S
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Chemical Name:
propan-2-yl 2-[(5-amino-1H-1,2,4-triazol-3-yl)sulfanyl]acetate
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Synonyms:
CHEMBL4129581;ZINC5835205;MFCD03621537;AKOS002350429;AKOS008903819;MCULE-4936979734;ST50198215;methylethyl 2-(5-amino-4H-1,2,4-triazol-3-ylthio)acetate;isopropyl [(5-amino-1H-1,2,4-triazol-3-yl)sulfanyl]acetate;496033-64-8
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CAS No:
propan-2-yl 2-[(5-amino-1H-1,2,4-triazol-3-yl)sulfanyl]acetate Basic Attributes
216.26 g/mol
216.06809681 g/mol
Computed Properties
Molecular Weight:216.26
XLogP3:1.2
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:5
Exact Mass:216.06809681
Monoisotopic Mass:216.06809681
Topological Polar Surface Area:119
Heavy Atom Count:14
Complexity:202
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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