TL;DR: AB00864623-06 (CAS 1214163-05-9) is a chemical compound with molecular formula C27H28N2O7 and molecular weight 492.18964 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-[2-(3-ethyl-4,8-dimethyl-2-oxochromen-7-yl)oxypropanoylamino]-3-(5-hydroxy-1H-indol-3-yl)propanoic acid
Also Known As: AB00864623-06, 2-(2-((3-ethyl-4,8-dimethyl-2-oxo-2H-chromen-7-yl)oxy)propanamido)-3-(5-hydroxy-1H-indol-3-yl)propanoic acid, N-{2-[(3-ethyl-4,8-dimethyl-2-oxo-2H-chromen-7-yl)oxy]propanoyl}-5-hydroxytryptophan, 2-[2-(3-ethyl-4,8-dimethyl-2-oxochromen-7-yl)oxypropanoylamino]-3-(5-hydroxy-1H-indol-3-yl)propanoic acid
| Molecular Formula | C27H28N2O7 |
| Molecular Weight | 492.18964 g/mol |
| XLogP | 4.1 |
| Topological Polar Surface Area (TPSA) | 138.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 8 |
| Exact Mass | 492.18964 Da |
| Heavy Atoms | 36 |
| Complexity | 889.0 |
| SMILES | CCC1=C(C2=C(C(=C(C=C2)OC(C)C(=O)NC(CC3=CNC4=C3C=C(C=C4)O)C(=O)O)C)OC1=O)C |
| InChIKey | FXNWWLOBYBKRAG-UHFFFAOYSA-N |
The XLogP value of 4.1 indicates that AB00864623-06 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 138.0 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00864623-06. Following Lipinski's Rule of Five, AB00864623-06 has 4 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of AB00864623-06 is 1214163-05-9.
The molecular formula of AB00864623-06 is C27H28N2O7.
The molecular weight of AB00864623-06 is 492.18964 g/mol.
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