![1-[(2R,4S,5S)-5-(chloromethyl)-4-hydroxy-tetrahydrofuran-2-yl]-5-(3-chloropropyl)pyrimidine-2,4-dione structure](/static/products/979/97975-06-9.png)
1-[(2R,4S,5S)-5-(chloromethyl)-4-hydroxy-tetrahydrofuran-2-yl]-5-(3-chloropropyl)pyrimidine-2,4-dione
TL;DR: 1-[(2R,4S,5S)-5-(chloromethyl)-4-hydroxy-tetrahydrofuran-2-yl]-5-(3-chloropropyl)pyrimidine-2,4-dione (CAS 97975-06-9) is a chemical compound with molecular formula C12H16Cl2N2O4 and molecular weight 322.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[(2R,4S,5S)-5-(chloromethyl)-4-hydroxyoxolan-2-yl]-5-(3-chloropropyl)pyrimidine-2,4-dione
Also Known As: 1-[(2R,4S,5S)-5-(chloromethyl)-4-hydroxy-tetrahydrofuran-2-yl]-5-(3-chloropropyl)pyrimidine-2,4-dione, 1-(5-Chloro-2,5-dideoxypentofuranosyl)-5-(3-chloropropyl)-4-hydroxypyrimidin-2(1H)-one, 1-(5-Chloro-2,5-dideoxy-beta-D-erythro-pentofuranosyl)-5-(3-chloropropyl)-4-hydroxypyrimidin-2(1H)-one, 1-(5-Chloromethyl-4-hydroxy-tetrahydro-furan-2-yl)-5-(3-chloro-propyl)-1H-pyrimidine-2,4-dione, 1-[(2R,4S,5S)-5-(chloromethyl)-4-hydroxyoxolan-2-yl]-5-(3-chloropropyl)pyrimidine-2,4-dione
| Molecular Formula | C12H16Cl2N2O4 |
|---|---|
| Molecular Weight | 322.05 g/mol |
| LogP | 0.4 |
| Topological Polar Surface Area | 78.9 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 322.0487 |
| Heavy Atoms | 20 |
| Complexity | 430.0 |
Chemical Identifiers
| CAS Number | 97975-06-9 |
|---|---|
| SMILES | C1[C@@H]([C@H](O[C@H]1N2C=C(C(=O)NC2=O)CCCCl)CCl)O |
| InChIKey | YKUKQBOEZCQEEQ-IVZWLZJFSA-N |
Product Overview
1-[(2R,4S,5S)-5-(chloromethyl)-4-hydroxy-tetrahydrofuran-2-yl]-5-(3-chloropropyl)pyrimidine-2,4-dione (CAS 97975-06-9), with molecular formula C12H16Cl2N2O4 and molecular weight 322.05 g/mol. IUPAC: 1-[(2R,4S,5S)-5-(chloromethyl)-4-hydroxyoxolan-2-yl]-5-(3-chloropropyl)pyrimidine-2,4-dione.
Chemical Property Profile of 1-[(2R,4S,5S)-5-(chloromethyl)-4-hydroxy-tetrahydrofuran-2-yl]-5-(3-chloropropyl)pyrimidine-2,4-dione
Property Insights of 1-[(2R,4S,5S)-5-(chloromethyl)-4-hydroxy-tetrahydrofuran-2-yl]-5-(3-chloropropyl)pyrimidine-2,4-dione
The XLogP value of 0.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-[(2R,4S,5S)-5-(chloromethyl)-4-hydroxy-tetrahydrofuran-2-yl]-5-(3-chloropropyl)pyrimidine-2,4-dione. The TPSA of 78.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-[(2R,4S,5S)-5-(chloromethyl)-4-hydroxy-tetrahydrofuran-2-yl]-5-(3-chloropropyl)pyrimidine-2,4-dione. Following Lipinski's Rule of Five, 1-[(2R,4S,5S)-5-(chloromethyl)-4-hydroxy-tetrahydrofuran-2-yl]-5-(3-chloropropyl)pyrimidine-2,4-dione has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1-[(2R,4S,5S)-5-(chloromethyl)-4-hydroxy-tetrahydrofuran-2-yl]-5-(3-chloropropyl)pyrimidine-2,4-dione?
The CAS number of 1-[(2R,4S,5S)-5-(chloromethyl)-4-hydroxy-tetrahydrofuran-2-yl]-5-(3-chloropropyl)pyrimidine-2,4-dione is 97975-06-9.
What is the molecular formula of 1-[(2R,4S,5S)-5-(chloromethyl)-4-hydroxy-tetrahydrofuran-2-yl]-5-(3-chloropropyl)pyrimidine-2,4-dione?
The molecular formula of 1-[(2R,4S,5S)-5-(chloromethyl)-4-hydroxy-tetrahydrofuran-2-yl]-5-(3-chloropropyl)pyrimidine-2,4-dione is C12H16Cl2N2O4.
What is the molecular weight of 1-[(2R,4S,5S)-5-(chloromethyl)-4-hydroxy-tetrahydrofuran-2-yl]-5-(3-chloropropyl)pyrimidine-2,4-dione?
The molecular weight of 1-[(2R,4S,5S)-5-(chloromethyl)-4-hydroxy-tetrahydrofuran-2-yl]-5-(3-chloropropyl)pyrimidine-2,4-dione is 322.05 g/mol.
Where can I buy 1-[(2R,4S,5S)-5-(chloromethyl)-4-hydroxy-tetrahydrofuran-2-yl]-5-(3-chloropropyl)pyrimidine-2,4-dione?
You can request a quote for 1-[(2R,4S,5S)-5-(chloromethyl)-4-hydroxy-tetrahydrofuran-2-yl]-5-(3-chloropropyl)pyrimidine-2,4-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-[(2R,4S,5S)-5-(chloromethyl)-4-hydroxy-tetrahydrofuran-2-yl]-5-(3-chloropropyl)pyrimidine-2,4-dione?
Yes, KEHONG BIO provides custom synthesis services for 1-[(2R,4S,5S)-5-(chloromethyl)-4-hydroxy-tetrahydrofuran-2-yl]-5-(3-chloropropyl)pyrimidine-2,4-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.