(2-{2-[({2-methyl-3-[(propan-2-yloxy)carbonyl]-1-benzofuran-5-yl}oxy)acetyl]hydrazinyl}-2-oxoethoxy)acetic acid
TL;DR: (2-{2-[({2-methyl-3-[(propan-2-yloxy)carbonyl]-1-benzofuran-5-yl}oxy)acetyl]hydrazinyl}-2-oxoethoxy)acetic acid (CAS 498538-29-7) is a chemical compound with molecular formula C19H22N2O9 and molecular weight 422.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[2-[2-[2-[(2-methyl-3-propan-2-yloxycarbonyl-1-benzofuran-5-yl)oxy]acetyl]hydrazinyl]-2-oxoethoxy]acetic acid
Also Known As: (2-{2-[({2-methyl-3-[(propan-2-yloxy)carbonyl]-1-benzofuran-5-yl}oxy)acetyl]hydrazinyl}-2-oxoethoxy)acetic acid, 2-(2-(2-(2-((3-(isopropoxycarbonyl)-2-methylbenzofuran-5-yl)oxy)acetyl)hydrazinyl)-2-oxoethoxy)acetic acid, 2-[2-[2-[2-[(2-methyl-3-propan-2-yloxycarbonyl-1-benzofuran-5-yl)oxy]acetyl]hydrazinyl]-2-oxoethoxy]acetic acid, 2-{[N-(2-{2-methyl-3-[(methylethyl)oxycarbonyl]benzo[b]furan-5-yloxy}acetylami no)carbamoyl]methoxy}acetic acid
| Molecular Formula | C19H22N2O9 |
|---|---|
| Molecular Weight | 422.13 g/mol |
| LogP | 0.93382 |
| Topological Polar Surface Area | 153.4 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 9 |
| Exact Mass | 422.13254 |
| Heavy Atoms | 30 |
| Complexity | 948.8733 |
Chemical Identifiers
| CAS Number | 498538-29-7 |
|---|---|
| SMILES | CC1=C(C2=C(O1)C=CC(=C2)OCC(=O)NNC(=O)COCC(=O)O)C(=O)OC(C)C |
Product Overview
(2-{2-[({2-methyl-3-[(propan-2-yloxy)carbonyl]-1-benzofuran-5-yl}oxy)acetyl]hydrazinyl}-2-oxoethoxy)acetic acid (CAS 498538-29-7), with molecular formula C19H22N2O9 and molecular weight 422.13 g/mol. IUPAC: 2-[2-[2-[2-[(2-methyl-3-propan-2-yloxycarbonyl-1-benzofuran-5-yl)oxy]acetyl]hydrazinyl]-2-oxoethoxy]acetic acid.
Chemical Property Profile of (2-{2-[({2-methyl-3-[(propan-2-yloxy)carbonyl]-1-benzofuran-5-yl}oxy)acetyl]hydrazinyl}-2-oxoethoxy)acetic acid
Property Insights of (2-{2-[({2-methyl-3-[(propan-2-yloxy)carbonyl]-1-benzofuran-5-yl}oxy)acetyl]hydrazinyl}-2-oxoethoxy)acetic acid
The XLogP value of 0.93382 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (2-{2-[({2-methyl-3-[(propan-2-yloxy)carbonyl]-1-benzofuran-5-yl}oxy)acetyl]hydrazinyl}-2-oxoethoxy)acetic acid. The TPSA of 153.4 Ų indicates high polarity, suggesting (2-{2-[({2-methyl-3-[(propan-2-yloxy)carbonyl]-1-benzofuran-5-yl}oxy)acetyl]hydrazinyl}-2-oxoethoxy)acetic acid may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, (2-{2-[({2-methyl-3-[(propan-2-yloxy)carbonyl]-1-benzofuran-5-yl}oxy)acetyl]hydrazinyl}-2-oxoethoxy)acetic acid has 3 hydrogen bond donor(s) and 8 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 (2-{2-[({2-methyl-3-[(propan-2-yloxy)carbonyl]-1-benzofuran-5-yl}oxy)acetyl]hydrazinyl}-2-oxoethoxy)acetic acid?
The CAS number of (2-{2-[({2-methyl-3-[(propan-2-yloxy)carbonyl]-1-benzofuran-5-yl}oxy)acetyl]hydrazinyl}-2-oxoethoxy)acetic acid is 498538-29-7.
What is the molecular formula of (2-{2-[({2-methyl-3-[(propan-2-yloxy)carbonyl]-1-benzofuran-5-yl}oxy)acetyl]hydrazinyl}-2-oxoethoxy)acetic acid?
The molecular formula of (2-{2-[({2-methyl-3-[(propan-2-yloxy)carbonyl]-1-benzofuran-5-yl}oxy)acetyl]hydrazinyl}-2-oxoethoxy)acetic acid is C19H22N2O9.
What is the molecular weight of (2-{2-[({2-methyl-3-[(propan-2-yloxy)carbonyl]-1-benzofuran-5-yl}oxy)acetyl]hydrazinyl}-2-oxoethoxy)acetic acid?
The molecular weight of (2-{2-[({2-methyl-3-[(propan-2-yloxy)carbonyl]-1-benzofuran-5-yl}oxy)acetyl]hydrazinyl}-2-oxoethoxy)acetic acid is 422.13 g/mol.
Where can I buy (2-{2-[({2-methyl-3-[(propan-2-yloxy)carbonyl]-1-benzofuran-5-yl}oxy)acetyl]hydrazinyl}-2-oxoethoxy)acetic acid?
You can request a quote for (2-{2-[({2-methyl-3-[(propan-2-yloxy)carbonyl]-1-benzofuran-5-yl}oxy)acetyl]hydrazinyl}-2-oxoethoxy)acetic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (2-{2-[({2-methyl-3-[(propan-2-yloxy)carbonyl]-1-benzofuran-5-yl}oxy)acetyl]hydrazinyl}-2-oxoethoxy)acetic acid?
Yes, KEHONG BIO provides custom synthesis services for (2-{2-[({2-methyl-3-[(propan-2-yloxy)carbonyl]-1-benzofuran-5-yl}oxy)acetyl]hydrazinyl}-2-oxoethoxy)acetic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.