N-[4-benzylsulfanyl-6-[[4-(hydroxymethyl)-7,7-dimethyl-3,6,8-trioxabicyclo[3.3.0]oct-2-yl]amino]-5-nitro-pyrimidin-2-yl]acetamide

Modify Date: 2025-08-24 08:46:54

N-[4-benzylsulfanyl-6-[[4-(hydroxymethyl)-7,7-dimethyl-3,6,8-trioxabicyclo[3.3.0]oct-2-yl]amino]-5-nitro-pyrimidin-2-yl]acetamide structure	Common Name	N-[4-benzylsulfanyl-6-[[4-(hydroxymethyl)-7,7-dimethyl-3,6,8-trioxabicyclo[3.3.0]oct-2-yl]amino]-5-nitro-pyrimidin-2-yl]acetamide
	CAS Number	59886-00-9	Molecular Weight	491.51800
	Density	1.48g/cm3	Boiling Point	N/A
	Molecular Formula	C₂₁H₂₅N₅O₇S	Melting Point	N/A
	MSDS	N/A	Flash Point	N/A

Name	N-[4-benzylsulfanyl-6-[[6-(hydroxymethyl)-2,2-dimethyl-3a,4,6,6a-tetrahydrofuro[3,4-d][1,3]dioxol-4-yl]amino]-5-nitropyrimidin-2-yl]acetamide

Density	1.48g/cm3
Molecular Formula	C₂₁H₂₅N₅O₇S
Molecular Weight	491.51800
Exact Mass	491.14700
PSA	185.95000
LogP	2.95390
Index of Refraction	1.656
InChIKey	GQGGPXBTVJTIEA-UHFFFAOYSA-N
SMILES	CC(=O)Nc1nc(NC2OC(CO)C3OC(C)(C)OC23)c([N+](=O)[O-])c(SCc2ccccc2)n1

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