12P-127
TL;DR: 12P-127 (CAS 1396966-97-4) is a chemical compound with molecular formula C22H22Cl2N2O6S2 and molecular weight 544.02966 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
ethyl 2-[(2,4-dichlorophenyl)sulfonylamino]-3-[3-(1,3-dioxoisoindol-2-yl)propylsulfanyl]propanoate
Also Known As: 12P-127, Ethyl 2-[(2,4-dichlorophenyl)sulfonylamino]-3-[3-(1,3-dioxoisoindol-2-yl)propylsulfanyl]propanoate, ethyl 2-{[(2,4-dichlorophenyl)sulfonyl]amino}-3-{[3-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)propyl]sulfanyl}propanoate, ethyl 2-(2,4-dichlorobenzenesulfonamido)-3-{[3-(1,3-dioxo-2,3-dihydro-1H-isoindol-2-yl)propyl]sulfanyl}propanoate, ethyl2-(2,4-dichlorobenzenesulfonamido)-3-{[3-(1,3-dioxo-2,3-dihydro-1H-isoindol-2-yl)propyl]sulfanyl}propanoate
Technical Specifications
| Molecular Formula | C22H22Cl2N2O6S2 |
| Molecular Weight | 544.02966 g/mol |
| XLogP | 4.1 |
| Topological Polar Surface Area (TPSA) | 144.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 12 |
| Exact Mass | 544.02966 Da |
| Heavy Atoms | 34 |
| Complexity | 829.0 |
| SMILES | CCOC(=O)C(CSCCCN1C(=O)C2=CC=CC=C2C1=O)NS(=O)(=O)C3=C(C=C(C=C3)Cl)Cl |
| InChIKey | JIWRRFPBMRKCDM-UHFFFAOYSA-N |
Chemical Property Profile of 12P-127
Property Insights of 12P-127
The XLogP value of 4.1 indicates that 12P-127 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 144.0 Ų indicates high polarity, suggesting 12P-127 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 12P-127 has 1 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of 12P-127?
The CAS number of 12P-127 is 1396966-97-4.
What is the molecular formula of 12P-127?
The molecular formula of 12P-127 is C22H22Cl2N2O6S2.
What is the molecular weight of 12P-127?
The molecular weight of 12P-127 is 544.02966 g/mol.
Where can I buy 12P-127?
You can request a quote for 12P-127 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 12P-127?
Yes, CoreyChem provides custom synthesis services for 12P-127 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.