2-[[4-amino-5-[(4-nitrophenyl)sulfonylamino]-6-oxo-3H-pyrimidin-2-yl]sulfanyl]acetic acid

Modify Date: 2025-12-06 18:04:05

2-[[4-amino-5-[(4-nitrophenyl)sulfonylamino]-6-oxo-3H-pyrimidin-2-yl]sulfanyl]acetic acid structure	Common Name	2-[[4-amino-5-[(4-nitrophenyl)sulfonylamino]-6-oxo-3H-pyrimidin-2-yl]sulfanyl]acetic acid
	CAS Number	91790-13-5	Molecular Weight	401.37500
	Density	N/A	Boiling Point	N/A
	Molecular Formula	C₁₂H₁₁N₅O₇S₂	Melting Point	N/A
	MSDS	N/A	Flash Point	N/A

Name	2-[[6-amino-5-[(4-nitrophenyl)sulfonylamino]-4-oxo-1H-pyrimidin-2-yl]sulfanyl]acetic acid

Molecular Formula	C₁₂H₁₁N₅O₇S₂
Molecular Weight	401.37500
Exact Mass	401.01000
PSA	234.74000
LogP	2.49600
InChIKey	ABQNQRGIUFYMIF-UHFFFAOYSA-N
SMILES	Nc1nc(SCC(=O)O)[nH]c(=O)c1NS(=O)(=O)c1ccc([N+](=O)[O-])cc1

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