3,N4-Ethano-2'-deoxycytidine
6-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-2,3-dihydroimidazo[1,2-c]pyrimidin-5-one
Also Known As: 3,N4-Ethano-2'-deoxycytidine|3,n4-ethanodeoxycytidine|Ligustrazine hydrochloride|3,N4-Etheno-2 -deoxycytidine|6-((2R,4S,5R)-4-Hydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl)-2,3-dihydroimidazo[1,2-c]pyrimidin-5(6H)-one|6-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-2,3-dihydroimidazo[1,2-c]pyrimidin-5-one|2,3,5,6-Tetrahydro5-oxo-6-(2-deoxy-beta-D-ribofuranosyl)imidazo[1,2-c]pyrimidine|2,3-Dihydro-6-(2-deoxy-beta-D-ribofuranosyl)imidazo[1,2-c]pyrimidine-5(6H)-one|6-(2-Deoxy-|A-D-erythro-pentofuranosyl)-2,6-dihydroimidazo[1,2-c]pyrimidin-5(3H)-one|6-(2-Deoxy-beta-D-erythro-pentofuranosyl)-2,3-dihydroimidazo[1,2-c]pyrimidin-5(6H)-one|6-(2-Deoxy-beta-D-erythro-pentofuranosyl)-2,6-dihydroimidazo[1,2-c]pyrimidin-5(3H)-one|3-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-1,3,7-triazabicyclo[4.3.0]nona-4,6-dien-2-one|6-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-2H,3H,5H,6H-imidazo[1,2-c]pyrimidin-5-one
| Molecular Formula | C11H15N3O4 |
|---|---|
| Molecular Weight | 253.10626 g/mol |
| LogP | -1.5 |
| Topological Polar Surface Area | 85.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 253.10626 |
| Monoisotopic Mass | 253.10626 |
| Heavy Atoms | 18 |
| Complexity | 423.0 |
Chemical Identifiers
| CAS Number | 76495-80-2 |
|---|---|
| SMILES | C1CN2C(=N1)C=CN(C2=O)[C@H]3C[C@@H]([C@H](O3)CO)O |
| InChIKey | KWPGIQIGXCZEFG-QXFUBDJGSA-N |
Product Overview
3,N4-Ethano-2'-deoxycytidine (CAS 76495-80-2), with molecular formula C11H15N3O4 and molecular weight 253.10626 g/mol. IUPAC: 6-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-2,3-dihydroimidazo[1,2-c]pyrimidin-5-one.