N-[(7,8-dimethoxy-4-methyl-2-oxo-2H-chromen-3-yl)acetyl]glycyl-L-isoleucine
TL;DR: N-[(7,8-dimethoxy-4-methyl-2-oxo-2H-chromen-3-yl)acetyl]glycyl-L-isoleucine (CAS 956048-17-2) is a chemical compound with molecular formula C22H28N2O8 and molecular weight 448.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S,3R)-2-[[2-[[2-(7,8-dimethoxy-4-methyl-2-oxochromen-3-yl)acetyl]amino]acetyl]amino]-3-methylpentanoic acid
Also Known As: N-[(7,8-dimethoxy-4-methyl-2-oxo-2H-chromen-3-yl)acetyl]glycyl-L-isoleucine, (2S,3R)-2-(2-(2-(7,8-dimethoxy-4-methyl-2-oxo-2H-chromen-3-yl)acetamido)acetamido)-3-methylpentanoic acid, (2S,3R)-2-[[2-[[2-(7,8-dimethoxy-4-methyl-2-oxochromen-3-yl)acetyl]amino]acetyl]amino]-3-methylpentanoic acid
| Molecular Formula | C22H28N2O8 |
|---|---|
| Molecular Weight | 448.18 g/mol |
| LogP | 1.39282 |
| Topological Polar Surface Area | 144.17 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 10 |
| Exact Mass | 448.18457 |
| Heavy Atoms | 32 |
| Complexity | 1075.7657 |
Chemical Identifiers
| CAS Number | 956048-17-2 |
|---|---|
| SMILES | CC[C@@H](C)[C@@H](C(=O)O)NC(=O)CNC(=O)CC1=C(C2=C(C(=C(C=C2)OC)OC)OC1=O)C |
Product Overview
N-[(7,8-dimethoxy-4-methyl-2-oxo-2H-chromen-3-yl)acetyl]glycyl-L-isoleucine (CAS 956048-17-2), with molecular formula C22H28N2O8 and molecular weight 448.18 g/mol. IUPAC: (2S,3R)-2-[[2-[[2-(7,8-dimethoxy-4-methyl-2-oxochromen-3-yl)acetyl]amino]acetyl]amino]-3-methylpentanoic acid.
Chemical Property Profile of N-[(7,8-dimethoxy-4-methyl-2-oxo-2H-chromen-3-yl)acetyl]glycyl-L-isoleucine
Property Insights of N-[(7,8-dimethoxy-4-methyl-2-oxo-2H-chromen-3-yl)acetyl]glycyl-L-isoleucine
The XLogP value of 1.39282 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-[(7,8-dimethoxy-4-methyl-2-oxo-2H-chromen-3-yl)acetyl]glycyl-L-isoleucine. The TPSA of 144.17 Ų indicates high polarity, suggesting N-[(7,8-dimethoxy-4-methyl-2-oxo-2H-chromen-3-yl)acetyl]glycyl-L-isoleucine may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, N-[(7,8-dimethoxy-4-methyl-2-oxo-2H-chromen-3-yl)acetyl]glycyl-L-isoleucine has 3 hydrogen bond donor(s) and 7 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 N-[(7,8-dimethoxy-4-methyl-2-oxo-2H-chromen-3-yl)acetyl]glycyl-L-isoleucine?
The CAS number of N-[(7,8-dimethoxy-4-methyl-2-oxo-2H-chromen-3-yl)acetyl]glycyl-L-isoleucine is 956048-17-2.
What is the molecular formula of N-[(7,8-dimethoxy-4-methyl-2-oxo-2H-chromen-3-yl)acetyl]glycyl-L-isoleucine?
The molecular formula of N-[(7,8-dimethoxy-4-methyl-2-oxo-2H-chromen-3-yl)acetyl]glycyl-L-isoleucine is C22H28N2O8.
What is the molecular weight of N-[(7,8-dimethoxy-4-methyl-2-oxo-2H-chromen-3-yl)acetyl]glycyl-L-isoleucine?
The molecular weight of N-[(7,8-dimethoxy-4-methyl-2-oxo-2H-chromen-3-yl)acetyl]glycyl-L-isoleucine is 448.18 g/mol.
Where can I buy N-[(7,8-dimethoxy-4-methyl-2-oxo-2H-chromen-3-yl)acetyl]glycyl-L-isoleucine?
You can request a quote for N-[(7,8-dimethoxy-4-methyl-2-oxo-2H-chromen-3-yl)acetyl]glycyl-L-isoleucine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[(7,8-dimethoxy-4-methyl-2-oxo-2H-chromen-3-yl)acetyl]glycyl-L-isoleucine?
Yes, KEHONG BIO provides custom synthesis services for N-[(7,8-dimethoxy-4-methyl-2-oxo-2H-chromen-3-yl)acetyl]glycyl-L-isoleucine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.