TL;DR: EiM07-29231 (CAS 1214204-37-1) is a chemical compound with molecular formula C29H21ClFNO6 and molecular weight 533.1041 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-(4-chlorophenyl)-2-[[2-[3-(4-fluorophenyl)-5-methyl-7-oxofuro[3,2-g]chromen-6-yl]acetyl]amino]propanoic acid
Also Known As: EiM07-29231, 4-chloro-N-{[3-(4-fluorophenyl)-5-methyl-7-oxo-7H-furo[3,2-g]chromen-6-yl]acetyl}phenylalanine, 3-(4-chlorophenyl)-2-(2-(3-(4-fluorophenyl)-5-methyl-7-oxo-7H-furo[3,2-g]chromen-6-yl)acetamido)propanoic acid, 3-(4-chlorophenyl)-2-[[2-[3-(4-fluorophenyl)-5-methyl-7-oxofuro[3,2-g]chromen-6-yl]acetyl]amino]propanoic acid
| Molecular Formula | C29H21ClFNO6 |
| Molecular Weight | 533.1041 g/mol |
| XLogP | 5.4 |
| Topological Polar Surface Area (TPSA) | 106.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 7 |
| Exact Mass | 533.1041 Da |
| Heavy Atoms | 38 |
| Complexity | 941.0 |
| SMILES | CC1=C(C(=O)OC2=CC3=C(C=C12)C(=CO3)C4=CC=C(C=C4)F)CC(=O)NC(CC5=CC=C(C=C5)Cl)C(=O)O |
| InChIKey | WOVRACABIYETOH-UHFFFAOYSA-N |
The XLogP value of 5.4 indicates that EiM07-29231 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 106.0 Ų falls within the moderate polarity range, balancing permeability and solubility for EiM07-29231. Following Lipinski's Rule of Five, EiM07-29231 has 2 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of EiM07-29231 is 1214204-37-1.
The molecular formula of EiM07-29231 is C29H21ClFNO6.
The molecular weight of EiM07-29231 is 533.1041 g/mol.
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