4-amino-1-[(2R,3S,4S,5R)-5-(fluoromethyl)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]pyrimidin-2-one;(2R,3S,4S,5R)-5-(4-amino-2-methylidenepyrimidin-1-yl)-2,4-bis(fluoromethyl)-2-(hydroxymethyl)oxolan-3-ol;(2R,3S,4S,5R)-5-(4-amino-2-methylidenepyrimidin-1-yl)-2-(difluoromethyl)-2-(hydroxymethyl)oxolane-3,4-diol;(2R,3S,5R)-5-(4-amino-2-methylidenepyrimidin-1-yl)-2-(difluoromethyl)-2-(hydroxymethyl)oxolan-3-ol;1-[(2R,3S,4S,5R)-3,5-bis(fluoromethyl)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-2-methylidenepyrimidin-4-one

C56H77F9N14O19 — CID 160817538

IUPAC4-amino-1-[(2R,3S,4S,5R)-5-(fluoromethyl)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]pyrimidin-2-one;(2R,3S,4S,5R)-5-(4-amino-2-methylidenepyrimidin-1-yl)-2,4-bis(fluoromethyl)-2-(hydroxymethyl)oxolan-3-ol;(2R,3S,4S,5R)-5-(4-amino-2-methylidenepyrimidin-1-yl)-2-(difluoromethyl)-2-(hydroxymethyl)oxolane-3,4-diol;(2R,3S,5R)-5-(4-amino-2-methylidenepyrimidin-1-yl)-2-(difluoromethyl)-2-(hydroxymethyl)oxolan-3-ol;1-[(2R,3S,4S,5R)-3,5-bis(fluoromethyl)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-2-methylidenepyrimidin-4-one
SMILESC=C1N=C(N)C=CN1[C@@H]1O[C@@](CO)(C(F)F)[C@@H](O)[C@@H]1O.C=C1N=C(N)C=CN1[C@@H]1O[C@@](CO)(CF)[C@@H](O)[C@@H]1CF.C=C1N=C(N)C=CN1[C@H]1C[C@H](O)[C@](CO)(C(F)F)O1.C=C1NC(=O)C=CN1[C@@H]1O[C@@](CO)(CF)[C@@H](O)[C@@H]1CF.Nc1ccn([C@@H]2O[C@@](CO)(CF)[C@@H](O)[C@@H]2O)c(=O)n1
InChIInChI=1S/C12H17F2N3O3.C12H16F2N2O4.C11H15F2N3O4.C11H15F2N3O3.C10H14FN3O5/c1-7-16-9(15)2-3-17(7)11-8(4-13)10(19)12(5-14,6-18)20-11;1-7-15-9(18)2-3-16(7)11-8(4-13)10(19)12(5-14,6-17)20-11;1-5-15-6(14)2-3-16(5)9-7(18)8(19)11(4-17,20-9)10(12)13;1-6-15-8(14)2-3-16(6)9-4-7(18)11(5-17,19-9)10(12)13;11-3-10(4-15)7(17)6(16)8(19-10)14-2-1-5(12)13-9(14)18/h2-3,8,10-11,18-19H,1,4-6H2,(H2,15,16);2-3,8,10-11,17,19H,1,4-6H2,(H,15,18);2-3,7-10,17-19H,1,4H2,(H2,14,15);2-3,7,9-10,17-18H,1,4-5H2,(H2,14,15);1-2,6-8,15-17H,3-4H2,(H2,12,13,18)/t2*8-,10-,11+,12+;7-,8-,9+,11+;7-,9+,11+;6-,7-,8+,10+/m00000/s1
InChIKeySFCFETNICQGOGL-ROUBOJSNSA-N
MW1421.29 g/mol
LogP-4.70
Rot. Bonds17

About 4-amino-1-[(2R,3S,4S,5R)-5-(fluoromethyl)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]pyrimidin-2-one;(2R,3S,4S,5R)-5-(4-amino-2-methylidenepyrimidin-1-yl)-2,4-bis(fluoromethyl)-2-(hydroxymethyl)oxolan-3-ol;(2R,3S,4S,5R)-5-(4-amino-2-methylidenepyrimidin-1-yl)-2-(difluoromethyl)-2-(hydroxymethyl)oxolane-3,4-diol;(2R,3S,5R)-5-(4-amino-2-methylidenepyrimidin-1-yl)-2-(difluoromethyl)-2-(hydroxymethyl)oxolan-3-ol;1-[(2R,3S,4S,5R)-3,5-bis(fluoromethyl)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-2-methylidenepyrimidin-4-one

4-amino-1-[(2R,3S,4S,5R)-5-(fluoromethyl)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]pyrimidin-2-one;(2R,3S,4S,5R)-5-(4-amino-2-methylidenepyrimidin-1-yl)-2,4-bis(fluoromethyl)-2-(hydroxymethyl)oxolan-3-ol;(2R,3S,4S,5R)-5-(4-amino-2-methylidenepyrimidin-1-yl)-2-(difluoromethyl)-2-(hydroxymethyl)oxolane-3,4-diol;(2R,3S,5R)-5-(4-amino-2-methylidenepyrimidin-1-yl)-2-(difluoromethyl)-2-(hydroxymethyl)oxolan-3-ol;1-[(2R,3S,4S,5R)-3,5-bis(fluoromethyl)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-2-methylidenepyrimidin-4-one (PubChem CID 160817538) has the molecular formula C56H77F9N14O19 and a molecular weight of 1421.29 g/mol. Its IUPAC name is 4-amino-1-[(2R,3S,4S,5R)-5-(fluoromethyl)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]pyrimidin-2-one;(2R,3S,4S,5R)-5-(4-amino-2-methylidenepyrimidin-1-yl)-2,4-bis(fluoromethyl)-2-(hydroxymethyl)oxolan-3-ol;(2R,3S,4S,5R)-5-(4-amino-2-methylidenepyrimidin-1-yl)-2-(difluoromethyl)-2-(hydroxymethyl)oxolane-3,4-diol;(2R,3S,5R)-5-(4-amino-2-methylidenepyrimidin-1-yl)-2-(difluoromethyl)-2-(hydroxymethyl)oxolan-3-ol;1-[(2R,3S,4S,5R)-3,5-bis(fluoromethyl)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-2-methylidenepyrimidin-4-one.

Molecular Properties

Compound Name4-amino-1-[(2R,3S,4S,5R)-5-(fluoromethyl)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]pyrimidin-2-one;(2R,3S,4S,5R)-5-(4-amino-2-methylidenepyrimidin-1-yl)-2,4-bis(fluoromethyl)-2-(hydroxymethyl)oxolan-3-ol;(2R,3S,4S,5R)-5-(4-amino-2-methylidenepyrimidin-1-yl)-2-(difluoromethyl)-2-(hydroxymethyl)oxolane-3,4-diol;(2R,3S,5R)-5-(4-amino-2-methylidenepyrimidin-1-yl)-2-(difluoromethyl)-2-(hydroxymethyl)oxolan-3-ol;1-[(2R,3S,4S,5R)-3,5-bis(fluoromethyl)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-2-methylidenepyrimidin-4-one
PubChem CID160817538
Molecular FormulaC56H77F9N14O19
Molecular Weight1421.29 g/mol
Exact Mass1420.53
IUPAC Name4-amino-1-[(2R,3S,4S,5R)-5-(fluoromethyl)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]pyrimidin-2-one;(2R,3S,4S,5R)-5-(4-amino-2-methylidenepyrimidin-1-yl)-2,4-bis(fluoromethyl)-2-(hydroxymethyl)oxolan-3-ol;(2R,3S,4S,5R)-5-(4-amino-2-methylidenepyrimidin-1-yl)-2-(difluoromethyl)-2-(hydroxymethyl)oxolane-3,4-diol;(2R,3S,5R)-5-(4-amino-2-methylidenepyrimidin-1-yl)-2-(difluoromethyl)-2-(hydroxymethyl)oxolan-3-ol;1-[(2R,3S,4S,5R)-3,5-bis(fluoromethyl)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-2-methylidenepyrimidin-4-one
SMILESC=C1N=C(N)C=CN1[C@@H]1O[C@@](CO)(C(F)F)[C@@H](O)[C@@H]1O.C=C1N=C(N)C=CN1[C@@H]1O[C@@](CO)(CF)[C@@H](O)[C@@H]1CF.C=C1N=C(N)C=CN1[C@H]1C[C@H](O)[C@](CO)(C(F)F)O1.C=C1NC(=O)C=CN1[C@@H]1O[C@@](CO)(CF)[C@@H](O)[C@@H]1CF.Nc1ccn([C@@H]2O[C@@](CO)(CF)[C@@H](O)[C@@H]2O)c(=O)n1
InChIInChI=1S/C12H17F2N3O3.C12H16F2N2O4.C11H15F2N3O4.C11H15F2N3O3.C10H14FN3O5/c1-7-16-9(15)2-3-17(7)11-8(4-13)10(19)12(5-14,6-18)20-11;1-7-15-9(18)2-3-16(7)11-8(4-13)10(19)12(5-14,6-17)20-11;1-5-15-6(14)2-3-16(5)9-7(18)8(19)11(4-17,20-9)10(12)13;1-6-15-8(14)2-3-16(6)9-4-7(18)11(5-17,19-9)10(12)13;11-3-10(4-15)7(17)6(16)8(19-10)14-2-1-5(12)13-9(14)18/h2-3,8,10-11,18-19H,1,4-6H2,(H2,15,16);2-3,8,10-11,17,19H,1,4-6H2,(H,15,18);2-3,7-10,17-19H,1,4H2,(H2,14,15);2-3,7,9-10,17-18H,1,4-5H2,(H2,14,15);1-2,6-8,15-17H,3-4H2,(H2,12,13,18)/t2*8-,10-,11+,12+;7-,8-,9+,11+;7-,9+,11+;6-,7-,8+,10+/m00000/s1
InChIKeySFCFETNICQGOGL-ROUBOJSNSA-N
XLogP-4.70
TPSA507.02 Ų
H-Bond Donors17
H-Bond Acceptors32
Rotatable Bonds17
Heavy Atoms98
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001421.29
LogP ≤ 5-4.70
H-Bond Donors ≤ 517
H-Bond Acceptors ≤ 1032

Analyze 4-amino-1-[(2R,3S,4S,5R)-5-(fluoromethyl)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]pyrimidin-2-one;(2R,3S,4S,5R)-5-(4-amino-2-methylidenepyrimidin-1-yl)-2,4-bis(fluoromethyl)-2-(hydroxymethyl)oxolan-3-ol;(2R,3S,4S,5R)-5-(4-amino-2-methylidenepyrimidin-1-yl)-2-(difluoromethyl)-2-(hydroxymethyl)oxolane-3,4-diol;(2R,3S,5R)-5-(4-amino-2-methylidenepyrimidin-1-yl)-2-(difluoromethyl)-2-(hydroxymethyl)oxolan-3-ol;1-[(2R,3S,4S,5R)-3,5-bis(fluoromethyl)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-2-methylidenepyrimidin-4-one with MolForge

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Related Compounds

4-amino-1-[3,4-dihydroxy-5,5-bis(hydroxymethyl)oxolan-2-yl]pyrimidin-2-one
CID 22677597
4-amino-1-[(2R,3S,4R,5R)-3-chloro-5-(fluoromethyl)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]pyrimidin-2-one
CID 118878411
4-amino-1-[(2R,3R,4R,5R)-3-fluoro-5-(fluoromethyl)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]pyrimidin-2-one
CID 71621665
4-amino-1-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)-5-propyloxolan-2-yl]pyrimidin-2-one
CID 23519668
4-amino-1-[(2R,3S,4S,5R)-3-ethynyl-5-(fluoromethyl)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]pyrimidin-2-one
CID 121429161
(2R,3R,4R,5R)-5-(4-amino-2-methylidenepyrimidin-1-yl)-4-chloro-2-(chloromethyl)-2-(hydroxymethyl)oxolan-3-ol;(2R,3R,4R,5R)-5-(4-amino-2-methylidenepyrimidin-1-yl)-4-chloro-2-ethenyl-2-(hydroxymethyl)oxolan-3-ol;(2R,3R,4R,5R)-5-(4-amino-2-methylidenepyrimidin-1-yl)-4-chloro-2-ethyl-2-(hydroxymethyl)oxolan-3-ol;(2R,3R,4R,5R)-5-(4-amino-2-methylidenepyrimidin-1-yl)-4-chloro-2-ethynyl-2-(hydroxymethyl)oxolan-3-ol;(2R,3R,4R,5R)-5-(4-amino-2-methylidenepyrimidin-1-yl)-4-chloro-2-(fluoromethyl)-2-(hydroxymethyl)oxolan-3-ol;(2R,3R,4R,5R)-5-(4-amino-2-methylidenepyrimidin-1-yl)-4-chloro-3-hydroxy-2-(hydroxymethyl)oxolane-2-carbonitrile;1-[(2R,3R,4R,5R)-3-chloro-5-(chloromethyl)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-2-methylidenepyrimidin-4-one;1-[(2R,3R,4R,5R)-3-chloro-5-ethenyl-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-2-methylidenepyrimidin-4-one;1-[(2R,3R,4R,5R)-3-chloro-5-ethyl-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-2-methylidenepyrimidin-4-one;1-[(2R,3R,4R,5R)-3-chloro-5-ethynyl-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-2-methylidenepyrimidin-4-one;1-[(2R,3R,4R,5R)-3-chloro-5-(fluoromethyl)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-2-methylidenepyrimidin-4-one;(2R,3R,4R,5R)-4-chloro-3-hydroxy-2-(hydroxymethyl)-5-(2-methylidene-4-oxopyrimidin-1-yl)oxolane-2-carbonitrile
CID 158165760
4-amino-1-[(2R,3S,4S,5R)-5-(difluoromethyl)-5-ethyl-3-hydroxy-4-methyloxolan-2-yl]pyrimidin-2-one
CID 118300189
4-amino-1-[5-(chloromethyl)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]pyrimidin-2-one
CID 123858985
4-amino-1-[(2R,3S,4S,5R)-3-(fluoromethyl)-4-hydroxy-5-(hydroxymethyl)-5-(methylideneamino)oxolan-2-yl]pyrimidin-2-one
CID 122581542
4-amino-1-[(2R,3R,4S,5R)-5-ethynyl-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]pyrimidin-2-one;(2R,3R,4R,5R)-5-(4-amino-2-methylidenepyrimidin-1-yl)-2-(azidomethyl)-2-[dideuterio(hydroxy)methyl]-4-fluorooxolan-3-ol;(2R,3R,5R)-5-(4-amino-2-methylidenepyrimidin-1-yl)-4,4-difluoro-2-(hydroxymethyl)-2-prop-2-enyloxolan-3-ol
CID 158305403
1-[(2R,3S,5R)-3,4-dihydroxy-5-(hydroxymethyl)-5-methyloxolan-2-yl]-2-methylidenepyrimidin-4-one
CID 122488489
1-[(3aS,4R,6R,6aR)-4-(chloromethyl)-4-ethylspiro[6,6a-dihydro-3aH-furo[3,4-d][1,3]dioxole-2,1'-cyclopentane]-6-yl]-4-aminopyrimidin-2-one;4-amino-1-[(2R,3R,4S,5R)-5-(chloromethyl)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]pyrimidin-2-one;4-amino-1-[(2R,3R,4S,5R)-5-(chloromethyl)-5-ethyl-3,4-dihydroxyoxolan-2-yl]pyrimidin-2-one
CID 159193441

Frequently Asked Questions

What is the IUPAC name of 4-amino-1-[(2R,3S,4S,5R)-5-(fluoromethyl)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]pyrimidin-2-one;(2R,3S,4S,5R)-5-(4-amino-2-methylidenepyrimidin-1-yl)-2,4-bis(fluoromethyl)-2-(hydroxymethyl)oxolan-3-ol;(2R,3S,4S,5R)-5-(4-amino-2-methylidenepyrimidin-1-yl)-2-(difluoromethyl)-2-(hydroxymethyl)oxolane-3,4-diol;(2R,3S,5R)-5-(4-amino-2-methylidenepyrimidin-1-yl)-2-(difluoromethyl)-2-(hydroxymethyl)oxolan-3-ol;1-[(2R,3S,4S,5R)-3,5-bis(fluoromethyl)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-2-methylidenepyrimidin-4-one?
The IUPAC name of 4-amino-1-[(2R,3S,4S,5R)-5-(fluoromethyl)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]pyrimidin-2-one;(2R,3S,4S,5R)-5-(4-amino-2-methylidenepyrimidin-1-yl)-2,4-bis(fluoromethyl)-2-(hydroxymethyl)oxolan-3-ol;(2R,3S,4S,5R)-5-(4-amino-2-methylidenepyrimidin-1-yl)-2-(difluoromethyl)-2-(hydroxymethyl)oxolane-3,4-diol;(2R,3S,5R)-5-(4-amino-2-methylidenepyrimidin-1-yl)-2-(difluoromethyl)-2-(hydroxymethyl)oxolan-3-ol;1-[(2R,3S,4S,5R)-3,5-bis(fluoromethyl)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-2-methylidenepyrimidin-4-one (CID 160817538) is 4-amino-1-[(2R,3S,4S,5R)-5-(fluoromethyl)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]pyrimidin-2-one;(2R,3S,4S,5R)-5-(4-amino-2-methylidenepyrimidin-1-yl)-2,4-bis(fluoromethyl)-2-(hydroxymethyl)oxolan-3-ol;(2R,3S,4S,5R)-5-(4-amino-2-methylidenepyrimidin-1-yl)-2-(difluoromethyl)-2-(hydroxymethyl)oxolane-3,4-diol;(2R,3S,5R)-5-(4-amino-2-methylidenepyrimidin-1-yl)-2-(difluoromethyl)-2-(hydroxymethyl)oxolan-3-ol;1-[(2R,3S,4S,5R)-3,5-bis(fluoromethyl)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-2-methylidenepyrimidin-4-one.
What is the SMILES notation for 4-amino-1-[(2R,3S,4S,5R)-5-(fluoromethyl)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]pyrimidin-2-one;(2R,3S,4S,5R)-5-(4-amino-2-methylidenepyrimidin-1-yl)-2,4-bis(fluoromethyl)-2-(hydroxymethyl)oxolan-3-ol;(2R,3S,4S,5R)-5-(4-amino-2-methylidenepyrimidin-1-yl)-2-(difluoromethyl)-2-(hydroxymethyl)oxolane-3,4-diol;(2R,3S,5R)-5-(4-amino-2-methylidenepyrimidin-1-yl)-2-(difluoromethyl)-2-(hydroxymethyl)oxolan-3-ol;1-[(2R,3S,4S,5R)-3,5-bis(fluoromethyl)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-2-methylidenepyrimidin-4-one?
The canonical SMILES for 4-amino-1-[(2R,3S,4S,5R)-5-(fluoromethyl)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]pyrimidin-2-one;(2R,3S,4S,5R)-5-(4-amino-2-methylidenepyrimidin-1-yl)-2,4-bis(fluoromethyl)-2-(hydroxymethyl)oxolan-3-ol;(2R,3S,4S,5R)-5-(4-amino-2-methylidenepyrimidin-1-yl)-2-(difluoromethyl)-2-(hydroxymethyl)oxolane-3,4-diol;(2R,3S,5R)-5-(4-amino-2-methylidenepyrimidin-1-yl)-2-(difluoromethyl)-2-(hydroxymethyl)oxolan-3-ol;1-[(2R,3S,4S,5R)-3,5-bis(fluoromethyl)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-2-methylidenepyrimidin-4-one is C=C1N=C(N)C=CN1[C@@H]1O[C@@](CO)(C(F)F)[C@@H](O)[C@@H]1O.C=C1N=C(N)C=CN1[C@@H]1O[C@@](CO)(CF)[C@@H](O)[C@@H]1CF.C=C1N=C(N)C=CN1[C@H]1C[C@H](O)[C@](CO)(C(F)F)O1.C=C1NC(=O)C=CN1[C@@H]1O[C@@](CO)(CF)[C@@H](O)[C@@H]1CF.Nc1ccn([C@@H]2O[C@@](CO)(CF)[C@@H](O)[C@@H]2O)c(=O)n1.
What is the InChIKey of 4-amino-1-[(2R,3S,4S,5R)-5-(fluoromethyl)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]pyrimidin-2-one;(2R,3S,4S,5R)-5-(4-amino-2-methylidenepyrimidin-1-yl)-2,4-bis(fluoromethyl)-2-(hydroxymethyl)oxolan-3-ol;(2R,3S,4S,5R)-5-(4-amino-2-methylidenepyrimidin-1-yl)-2-(difluoromethyl)-2-(hydroxymethyl)oxolane-3,4-diol;(2R,3S,5R)-5-(4-amino-2-methylidenepyrimidin-1-yl)-2-(difluoromethyl)-2-(hydroxymethyl)oxolan-3-ol;1-[(2R,3S,4S,5R)-3,5-bis(fluoromethyl)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-2-methylidenepyrimidin-4-one?
The InChIKey is SFCFETNICQGOGL-ROUBOJSNSA-N. The full InChI is InChI=1S/C12H17F2N3O3.C12H16F2N2O4.C11H15F2N3O4.C11H15F2N3O3.C10H14FN3O5/c1-7-16-9(15)2-3-17(7)11-8(4-13)10(19)12(5-14,6-18)20-11;1-7-15-9(18)2-3-16(7)11-8(4-13)10(19)12(5-14,6-17)20-11;1-5-15-6(14)2-3-16(5)9-7(18)8(19)11(4-17,20-9)10(12)13;1-6-15-8(14)2-3-16(6)9-4-7(18)11(5-17,19-9)10(12)13;11-3-10(4-15)7(17)6(16)8(19-10)14-2-1-5(12)13-9(14)18/h2-3,8,10-11,18-19H,1,4-6H2,(H2,15,16);2-3,8,10-11,17,19H,1,4-6H2,(H,15,18);2-3,7-10,17-19H,1,4H2,(H2,14,15);2-3,7,9-10,17-18H,1,4-5H2,(H2,14,15);1-2,6-8,15-17H,3-4H2,(H2,12,13,18)/t2*8-,10-,11+,12+;7-,8-,9+,11+;7-,9+,11+;6-,7-,8+,10+/m00000/s1.
What are the key properties of 4-amino-1-[(2R,3S,4S,5R)-5-(fluoromethyl)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]pyrimidin-2-one;(2R,3S,4S,5R)-5-(4-amino-2-methylidenepyrimidin-1-yl)-2,4-bis(fluoromethyl)-2-(hydroxymethyl)oxolan-3-ol;(2R,3S,4S,5R)-5-(4-amino-2-methylidenepyrimidin-1-yl)-2-(difluoromethyl)-2-(hydroxymethyl)oxolane-3,4-diol;(2R,3S,5R)-5-(4-amino-2-methylidenepyrimidin-1-yl)-2-(difluoromethyl)-2-(hydroxymethyl)oxolan-3-ol;1-[(2R,3S,4S,5R)-3,5-bis(fluoromethyl)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-2-methylidenepyrimidin-4-one?
4-amino-1-[(2R,3S,4S,5R)-5-(fluoromethyl)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]pyrimidin-2-one;(2R,3S,4S,5R)-5-(4-amino-2-methylidenepyrimidin-1-yl)-2,4-bis(fluoromethyl)-2-(hydroxymethyl)oxolan-3-ol;(2R,3S,4S,5R)-5-(4-amino-2-methylidenepyrimidin-1-yl)-2-(difluoromethyl)-2-(hydroxymethyl)oxolane-3,4-diol;(2R,3S,5R)-5-(4-amino-2-methylidenepyrimidin-1-yl)-2-(difluoromethyl)-2-(hydroxymethyl)oxolan-3-ol;1-[(2R,3S,4S,5R)-3,5-bis(fluoromethyl)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-2-methylidenepyrimidin-4-one has a molecular weight of 1421.29 g/mol, XLogP of -4.70, 17 rotatable bonds, 17 hydrogen bond donors, and 32 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-1-[(2R,3S,4S,5R)-5-(fluoromethyl)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]pyrimidin-2-one;(2R,3S,4S,5R)-5-(4-amino-2-methylidenepyrimidin-1-yl)-2,4-bis(fluoromethyl)-2-(hydroxymethyl)oxolan-3-ol;(2R,3S,4S,5R)-5-(4-amino-2-methylidenepyrimidin-1-yl)-2-(difluoromethyl)-2-(hydroxymethyl)oxolane-3,4-diol;(2R,3S,5R)-5-(4-amino-2-methylidenepyrimidin-1-yl)-2-(difluoromethyl)-2-(hydroxymethyl)oxolan-3-ol;1-[(2R,3S,4S,5R)-3,5-bis(fluoromethyl)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-2-methylidenepyrimidin-4-one is sourced from PubChem (CID 160817538), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).