Mdl 28753
TL;DR: Mdl 28753 (CAS 129509-46-2) is a chemical compound with molecular formula C27H40O5S and molecular weight 476.25964 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-[(Z,1S)-1-(2-carboxyethylsulfanyl)-11-phenylundec-2-enyl]-4-hydroxycyclohexane-1-carboxylic acid
Also Known As: Mdl 28753, Mdl 28,753, 4-[(Z,1S)-1-(2-carboxyethylsulfanyl)-11-phenylundec-2-enyl]-4-hydroxycyclohexane-1-carboxylic acid, (4(S)-(1alpha,4beta,4(Z)))-4-(1-((2-Carboxyethyl)thio)-11-phenyl-2-undecenyl)-4-hydroxycyclohexanecarboxylic acid, 4-(1-((2-Carboxyethyl)thio)-11-phenyl-2-undecenyl)-4-hydroxy-,(4(S)-(1alpha, 4beta, 4(Z)))-cyclohexanecarboxylic acid
Technical Specifications
| Molecular Formula | C27H40O5S |
| Molecular Weight | 476.25964 g/mol |
| XLogP | 6.3 |
| Topological Polar Surface Area (TPSA) | 120.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 16 |
| Exact Mass | 476.25964 Da |
| Heavy Atoms | 33 |
| Complexity | 591.0 |
| SMILES | C1CC(CCC1C(=O)O)([C@H](/C=C\CCCCCCCCC2=CC=CC=C2)SCCC(=O)O)O |
| InChIKey | NHVMAVIXHNUKST-HBNFAZCVSA-N |
Chemical Property Profile of Mdl 28753
Property Insights of Mdl 28753
The XLogP value of 6.3 indicates that Mdl 28753 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 120.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Mdl 28753. Following Lipinski's Rule of Five, Mdl 28753 has 3 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of Mdl 28753?
The CAS number of Mdl 28753 is 129509-46-2.
What is the molecular formula of Mdl 28753?
The molecular formula of Mdl 28753 is C27H40O5S.
What is the molecular weight of Mdl 28753?
The molecular weight of Mdl 28753 is 476.25964 g/mol.
Where can I buy Mdl 28753?
You can request a quote for Mdl 28753 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Mdl 28753?
Yes, CoreyChem provides custom synthesis services for Mdl 28753 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.