TL;DR: AB00864506-06 (CAS 1214864-54-6) is a chemical compound with molecular formula C27H22N2O7 and molecular weight 486.1427 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-(5-hydroxy-1H-indol-3-yl)-2-[2-(6-oxobenzo[c]chromen-3-yl)oxypropanoylamino]propanoic acid
Also Known As: AB00864506-06, 3-(5-hydroxy-1H-indol-3-yl)-2-(2-((6-oxo-6H-benzo[c]chromen-3-yl)oxy)propanamido)propanoic acid, 5-hydroxy-N-{2-[(6-oxo-6H-benzo[c]chromen-3-yl)oxy]propanoyl}tryptophan, 3-(5-hydroxy-1H-indol-3-yl)-2-[2-(6-oxobenzo[c]chromen-3-yl)oxypropanoylamino]propanoic acid
| Molecular Formula | C27H22N2O7 |
| Molecular Weight | 486.1427 g/mol |
| XLogP | 4.1 |
| Topological Polar Surface Area (TPSA) | 138.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 7 |
| Exact Mass | 486.1427 Da |
| Heavy Atoms | 36 |
| Complexity | 837.0 |
| SMILES | CC(C(=O)NC(CC1=CNC2=C1C=C(C=C2)O)C(=O)O)OC3=CC4=C(C=C3)C5=CC=CC=C5C(=O)O4 |
| InChIKey | MDKAWFIEKHSDSV-UHFFFAOYSA-N |
The XLogP value of 4.1 indicates that AB00864506-06 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 AB00864506-06. Following Lipinski's Rule of Five, AB00864506-06 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 AB00864506-06 is 1214864-54-6.
The molecular formula of AB00864506-06 is C27H22N2O7.
The molecular weight of AB00864506-06 is 486.1427 g/mol.
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