TL;DR: ONO 1016 (CAS 114668-76-7) is a chemical compound with molecular formula C24H23Cl2NO7 and molecular weight 507.08514 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(2S)-2-[[(1S,3S)-3-(4-benzoyl-2,3-dichlorophenoxy)cyclopentanecarbonyl]amino]pentanedioic acid
Also Known As: ONO 1016, L-Glutamic acid, N-((3-(4-benzoyl-2,3-dichlorophenoxy)cyclopentyl)carbonyl)-, (1S-trans)-, (1S-trans)-N-((3-(4-Benzoyl-2,3-dichlorophenoxy)cyclopentyl)carbonyl)-L-glutamic acid, L-Glutamic acid, N-(((1S,3S)-3-(4-benzoyl-2,3-dichlorophenoxy)cyclopentyl)carbonyl)-, N-[(1S,3S)-3-(4-Benzoyl-2,3-dichlorophenoxy)cyclopentane-1-carbonyl]-L-glutamic acid
| Molecular Formula | C24H23Cl2NO7 |
| Molecular Weight | 507.08514 g/mol |
| XLogP | 4.2 |
| Topological Polar Surface Area (TPSA) | 130.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 10 |
| Exact Mass | 507.08514 Da |
| Heavy Atoms | 34 |
| Complexity | 758.0 |
| SMILES | C1C[C@@H](C[C@H]1C(=O)N[C@@H](CCC(=O)O)C(=O)O)OC2=C(C(=C(C=C2)C(=O)C3=CC=CC=C3)Cl)Cl |
| InChIKey | LIZCUFJOLZTAKO-ZOBUZTSGSA-N |
The XLogP value of 4.2 indicates that ONO 1016 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 130.0 Ų falls within the moderate polarity range, balancing permeability and solubility for ONO 1016. Following Lipinski's Rule of Five, ONO 1016 has 3 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of ONO 1016 is 114668-76-7.
The molecular formula of ONO 1016 is C24H23Cl2NO7.
The molecular weight of ONO 1016 is 507.08514 g/mol.
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