![3-{2-[(Carbamoylmethyl)sulfanyl]-4,6-dimethylpyrimidin-5-yl}propanoic acid structure](/static/products/873/873208-65-2.png)
3-{2-[(Carbamoylmethyl)sulfanyl]-4,6-dimethylpyrimidin-5-yl}propanoic acid
TL;DR: 3-{2-[(Carbamoylmethyl)sulfanyl]-4,6-dimethylpyrimidin-5-yl}propanoic acid (CAS 873208-65-2) is a chemical compound with molecular formula C11H15N3O3S and molecular weight 269.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[2-(2-amino-2-oxoethyl)sulfanyl-4,6-dimethylpyrimidin-5-yl]propanoic acid
Also Known As: 3-{2-[(carbamoylmethyl)sulfanyl]-4,6-dimethylpyrimidin-5-yl}propanoic acid, 3-{2-[(2-amino-2-oxoethyl)thio]-4,6-dimethylpyrimidin-5-yl}propanoic acid, 3-(2-((2-Amino-2-oxoethyl)thio)-4,6-dimethylpyrimidin-5-yl)propanoic acid, 2-[(2-Amino-2-oxoethyl)thio]-4,6-dimethyl-5-pyrimidinepropanoic acid, 3-[2-(carbamoylmethylsulfanyl)-4,6-dimethyl-pyrimidin-5-yl]propanoic Acid
| Molecular Formula | C11H15N3O3S |
|---|---|
| Molecular Weight | 269.08 g/mol |
| LogP | 0.68804 |
| Topological Polar Surface Area | 106.17 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 269.0834 |
| Heavy Atoms | 18 |
| Complexity | 453.5964 |
Chemical Identifiers
| CAS Number | 873208-65-2 |
|---|---|
| SMILES | CC1=C(C(=NC(=N1)SCC(=O)N)C)CCC(=O)O |
Product Overview
3-{2-[(Carbamoylmethyl)sulfanyl]-4,6-dimethylpyrimidin-5-yl}propanoic acid (CAS 873208-65-2), with molecular formula C11H15N3O3S and molecular weight 269.08 g/mol. IUPAC: 3-[2-(2-amino-2-oxoethyl)sulfanyl-4,6-dimethylpyrimidin-5-yl]propanoic acid.
Chemical Property Profile of 3-{2-[(Carbamoylmethyl)sulfanyl]-4,6-dimethylpyrimidin-5-yl}propanoic acid
Property Insights of 3-{2-[(Carbamoylmethyl)sulfanyl]-4,6-dimethylpyrimidin-5-yl}propanoic acid
The XLogP value of 0.68804 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-{2-[(Carbamoylmethyl)sulfanyl]-4,6-dimethylpyrimidin-5-yl}propanoic acid. The TPSA of 106.17 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-{2-[(Carbamoylmethyl)sulfanyl]-4,6-dimethylpyrimidin-5-yl}propanoic acid. Following Lipinski's Rule of Five, 3-{2-[(Carbamoylmethyl)sulfanyl]-4,6-dimethylpyrimidin-5-yl}propanoic acid has 2 hydrogen bond donor(s) and 5 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 3-{2-[(Carbamoylmethyl)sulfanyl]-4,6-dimethylpyrimidin-5-yl}propanoic acid?
The CAS number of 3-{2-[(Carbamoylmethyl)sulfanyl]-4,6-dimethylpyrimidin-5-yl}propanoic acid is 873208-65-2.
What is the molecular formula of 3-{2-[(Carbamoylmethyl)sulfanyl]-4,6-dimethylpyrimidin-5-yl}propanoic acid?
The molecular formula of 3-{2-[(Carbamoylmethyl)sulfanyl]-4,6-dimethylpyrimidin-5-yl}propanoic acid is C11H15N3O3S.
What is the molecular weight of 3-{2-[(Carbamoylmethyl)sulfanyl]-4,6-dimethylpyrimidin-5-yl}propanoic acid?
The molecular weight of 3-{2-[(Carbamoylmethyl)sulfanyl]-4,6-dimethylpyrimidin-5-yl}propanoic acid is 269.08 g/mol.
Where can I buy 3-{2-[(Carbamoylmethyl)sulfanyl]-4,6-dimethylpyrimidin-5-yl}propanoic acid?
You can request a quote for 3-{2-[(Carbamoylmethyl)sulfanyl]-4,6-dimethylpyrimidin-5-yl}propanoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-{2-[(Carbamoylmethyl)sulfanyl]-4,6-dimethylpyrimidin-5-yl}propanoic acid?
Yes, KEHONG BIO provides custom synthesis services for 3-{2-[(Carbamoylmethyl)sulfanyl]-4,6-dimethylpyrimidin-5-yl}propanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.