AC1Q3UTF

1-[(3aR,4R,6R,6aR)-2-[4-[2-chloroethyl(methyl)amino]phenyl]-6-(hydroxymethyl)-3a,4,6,6a-tetrahydrofuro[3,4-d][1,3]dioxol-4-yl]pyrimidine-2,4-dione

Also Known As: Uridine, 2',3'-o-(p-((2-chloroethyl)methylamino)benzylidene)-|2',3'-O-(4-(N-2-Chloroethyl-N-methylamino)-benzylidine)-uridine|1-[(3aR,4R,6R,6aR)-2-[4-[2-chloroethyl(methyl)amino]phenyl]-6-(hydroxymethyl)-3a,4,6,6a-tetrahydrofuro[3,4-d][1,3]dioxol-4-yl]pyrimidine-2,4-dione|2',3'-o-{4-[(2-chloroethyl)(methyl)amino]benzylidene}uridine|2/'-O,3/'-O-[p-[(2-Chloroethyl)methylamino]benzylidene]uridine|2 -O,3 -O-[p-[(2-Chloroethyl)methylamino]benzylidene]uridine|O2',O3'-{4-[(2-chloro-ethyl)-methyl-amino]-benzylidene}-uridine|Uridine, 2',3'-O-[p-[(2-chloroethyl)methylamino]benzylidene]-|Uridine, 2',3'-O-[[4-[(2-chloroethyl)methylamino]phenyl]methylene]-|1-((3aR,4R,6R,6aR)-2-{4-[(2-Chloro-ethyl)-methyl-amino]-phenyl}-6-hydroxymethyl-tetrahydro-furo[3,4-d][1,3]dioxol-4-yl)-1H-pyrimidine-2,4-dione|1-[(3aR,4R,6R,6aR)-2-{4-[(2-chloroethyl)(methyl)amino]phenyl}-6-(hydroxymethyl)-tetrahydro-2H-furo[3,4-d][1,3]dioxol-4-yl]-1,2,3,4-tetrahydropyrimidine-2,4-dione|1-[2,3-O-({4-[(2-Chloroethyl)(methyl)amino]phenyl}methylidene)-beta-D-ribofuranosyl]-4-hydroxypyrimidin-2(1H)-one|1-[2,3-O-({4-[(2-Chloroethyl)(methyl)amino]phenyl}methylidene)pentofuranosyl]-4-hydroxypyrimidin-2(1H)-one

Molecular Formula	C19H22ClN3O6
Molecular Weight	423.11972 g/mol
LogP	0.3
Topological Polar Surface Area	101.0 Ų
Hydrogen Bond Donors	2
Hydrogen Bond Acceptors	7
Rotatable Bonds	6
Exact Mass	423.11972
Monoisotopic Mass	423.11972
Heavy Atoms	29
Complexity	656.0

Chemical Identifiers

CAS Number	21602-62-0
SMILES	CN(CCCl)C1=CC=C(C=C1)C2O[C@@H]3[C@H](O[C@H]([C@@H]3O2)N4C=CC(=O)NC4=O)CO
InChIKey	GNQAGVDLLRKCAQ-XWEABGILSA-N