(Dimethoxyphosphinyl)acetic acid 1-(2,4-dioxo-5-iodo-1,2,3,4-tetrahydropyrimidin-1-yl)-2-Beta-D-erythro-pentofuranos-5-yl ester
TL;DR: (Dimethoxyphosphinyl)acetic acid 1-(2,4-dioxo-5-iodo-1,2,3,4-tetrahydropyrimidin-1-yl)-2-Beta-D-erythro-pentofuranos-5-yl ester (CAS 115365-23-6) is a chemical compound with molecular formula C13H18IN2O9P and molecular weight 503.97946 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[(2R,3S,5R)-3-hydroxy-5-(5-iodo-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methyl 2-dimethoxyphosphorylacetate
Also Known As: (Dimethoxyphosphinyl)acetic acid 1-(2,4-dioxo-5-iodo-1,2,3,4-tetrahydropyrimidin-1-yl)-2-Beta-D-erythro-pentofuranos-5-yl ester, [(2R,3S,5R)-3-hydroxy-5-(5-iodo-2,4-dioxo-pyrimidin-1-yl)tetrahydrofuran-2-yl]methyl 2-dimethoxyphosphorylacetate, [(2R,3S,5R)-3-hydroxy-5-(5-iodo-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methyl 2-dimethoxyphosphorylacetate, 1-{2-Deoxy-5-O-[(dimethoxyphosphoryl)acetyl]-beta-D-erythro-pentofuranosyl}-4-hydroxy-5-iodopyrimidin-2(1H)-one, 1-{2-Deoxy-5-O-[(dimethoxyphosphoryl)acetyl]pentofuranosyl}-4-hydroxy-5-iodopyrimidin-2(1H)-one
Technical Specifications
| Molecular Formula | C13H18IN2O9P |
| Molecular Weight | 503.97946 g/mol |
| XLogP | -1.7 |
| Topological Polar Surface Area (TPSA) | 141.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 8 |
| Exact Mass | 503.97946 Da |
| Heavy Atoms | 26 |
| Complexity | 662.0 |
| SMILES | COP(=O)(CC(=O)OC[C@@H]1[C@H](C[C@@H](O1)N2C=C(C(=O)NC2=O)I)O)OC |
| InChIKey | RYGVMOFBUQQDNA-IVZWLZJFSA-N |
Chemical Property Profile of (Dimethoxyphosphinyl)acetic acid 1-(2,4-dioxo-5-iodo-1,2,3,4-tetrahydropyrimidin-1-yl)-2-Beta-D-erythro-pentofuranos-5-yl ester
Property Insights of (Dimethoxyphosphinyl)acetic acid 1-(2,4-dioxo-5-iodo-1,2,3,4-tetrahydropyrimidin-1-yl)-2-Beta-D-erythro-pentofuranos-5-yl ester
The XLogP value of -1.7 indicates that (Dimethoxyphosphinyl)acetic acid 1-(2,4-dioxo-5-iodo-1,2,3,4-tetrahydropyrimidin-1-yl)-2-Beta-D-erythro-pentofuranos-5-yl ester is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 141.0 Ų indicates high polarity, suggesting (Dimethoxyphosphinyl)acetic acid 1-(2,4-dioxo-5-iodo-1,2,3,4-tetrahydropyrimidin-1-yl)-2-Beta-D-erythro-pentofuranos-5-yl ester may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, (Dimethoxyphosphinyl)acetic acid 1-(2,4-dioxo-5-iodo-1,2,3,4-tetrahydropyrimidin-1-yl)-2-Beta-D-erythro-pentofuranos-5-yl ester has 2 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of (Dimethoxyphosphinyl)acetic acid 1-(2,4-dioxo-5-iodo-1,2,3,4-tetrahydropyrimidin-1-yl)-2-Beta-D-erythro-pentofuranos-5-yl ester?
The CAS number of (Dimethoxyphosphinyl)acetic acid 1-(2,4-dioxo-5-iodo-1,2,3,4-tetrahydropyrimidin-1-yl)-2-Beta-D-erythro-pentofuranos-5-yl ester is 115365-23-6.
What is the molecular formula of (Dimethoxyphosphinyl)acetic acid 1-(2,4-dioxo-5-iodo-1,2,3,4-tetrahydropyrimidin-1-yl)-2-Beta-D-erythro-pentofuranos-5-yl ester?
The molecular formula of (Dimethoxyphosphinyl)acetic acid 1-(2,4-dioxo-5-iodo-1,2,3,4-tetrahydropyrimidin-1-yl)-2-Beta-D-erythro-pentofuranos-5-yl ester is C13H18IN2O9P.
What is the molecular weight of (Dimethoxyphosphinyl)acetic acid 1-(2,4-dioxo-5-iodo-1,2,3,4-tetrahydropyrimidin-1-yl)-2-Beta-D-erythro-pentofuranos-5-yl ester?
The molecular weight of (Dimethoxyphosphinyl)acetic acid 1-(2,4-dioxo-5-iodo-1,2,3,4-tetrahydropyrimidin-1-yl)-2-Beta-D-erythro-pentofuranos-5-yl ester is 503.97946 g/mol.
Where can I buy (Dimethoxyphosphinyl)acetic acid 1-(2,4-dioxo-5-iodo-1,2,3,4-tetrahydropyrimidin-1-yl)-2-Beta-D-erythro-pentofuranos-5-yl ester?
You can request a quote for (Dimethoxyphosphinyl)acetic acid 1-(2,4-dioxo-5-iodo-1,2,3,4-tetrahydropyrimidin-1-yl)-2-Beta-D-erythro-pentofuranos-5-yl ester directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for (Dimethoxyphosphinyl)acetic acid 1-(2,4-dioxo-5-iodo-1,2,3,4-tetrahydropyrimidin-1-yl)-2-Beta-D-erythro-pentofuranos-5-yl ester?
Yes, CoreyChem provides custom synthesis services for (Dimethoxyphosphinyl)acetic acid 1-(2,4-dioxo-5-iodo-1,2,3,4-tetrahydropyrimidin-1-yl)-2-Beta-D-erythro-pentofuranos-5-yl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.