12-((-5-Iodo-4-azido-2-hydroxybenzoyl)amino)dodecanoic acid cholesteryl ester
TL;DR: 12-((-5-Iodo-4-azido-2-hydroxybenzoyl)amino)dodecanoic acid cholesteryl ester (CAS 125108-88-5) is a chemical compound with molecular formula C46H71IN4O4 and molecular weight 870.452 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[(10R,13R,17R)-10,13-dimethyl-17-[(2R)-6-methylheptan-2-yl]-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl] 12-[(4-azido-2-hydroxy-5-iodobenzoyl)amino]dodecanoate
Also Known As: Ifa-cea, 12-((-5-Iodo-4-azido-2-hydroxybenzoyl)amino)dodecanoic acid cholesteryl ester, [(10R,13R,17R)-10,13-dimethyl-17-[(2R)-6-methylheptan-2-yl]-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl] 12-[(4-azido-2-hydroxy-5-iodobenzoyl)amino]dodecanoate, Cholest-5-en-3-ol (3beta)-, 12-((4-azido-2-hydroxy-5-(iodo-125I)benzoyl)amino)dodecanoate
Technical Specifications
| Molecular Formula | C46H71IN4O4 |
| Molecular Weight | 870.452 g/mol |
| XLogP | 16.1 |
| Topological Polar Surface Area (TPSA) | 90.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 21 |
| Exact Mass | 870.452 Da |
| Heavy Atoms | 55 |
| Complexity | 1330.0 |
| SMILES | C[C@H](CCCC(C)C)[C@H]1CCC2[C@@]1(CCC3C2CC=C4[C@@]3(CCC(C4)OC(=O)CCCCCCCCCCCNC(=O)C5=CC(=C(C=C5O)N=[N+]=[N-])I)C)C |
| InChIKey | WASFNXUOAXICMC-GPVRCZESSA-N |
Chemical Property Profile of 12-((-5-Iodo-4-azido-2-hydroxybenzoyl)amino)dodecanoic acid cholesteryl ester
Property Insights of 12-((-5-Iodo-4-azido-2-hydroxybenzoyl)amino)dodecanoic acid cholesteryl ester
The XLogP value of 16.1 indicates that 12-((-5-Iodo-4-azido-2-hydroxybenzoyl)amino)dodecanoic acid cholesteryl ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 90.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 12-((-5-Iodo-4-azido-2-hydroxybenzoyl)amino)dodecanoic acid cholesteryl ester. Following Lipinski's Rule of Five, 12-((-5-Iodo-4-azido-2-hydroxybenzoyl)amino)dodecanoic acid cholesteryl ester has 2 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 12-((-5-Iodo-4-azido-2-hydroxybenzoyl)amino)dodecanoic acid cholesteryl ester?
The CAS number of 12-((-5-Iodo-4-azido-2-hydroxybenzoyl)amino)dodecanoic acid cholesteryl ester is 125108-88-5.
What is the molecular formula of 12-((-5-Iodo-4-azido-2-hydroxybenzoyl)amino)dodecanoic acid cholesteryl ester?
The molecular formula of 12-((-5-Iodo-4-azido-2-hydroxybenzoyl)amino)dodecanoic acid cholesteryl ester is C46H71IN4O4.
What is the molecular weight of 12-((-5-Iodo-4-azido-2-hydroxybenzoyl)amino)dodecanoic acid cholesteryl ester?
The molecular weight of 12-((-5-Iodo-4-azido-2-hydroxybenzoyl)amino)dodecanoic acid cholesteryl ester is 870.452 g/mol.
Where can I buy 12-((-5-Iodo-4-azido-2-hydroxybenzoyl)amino)dodecanoic acid cholesteryl ester?
You can request a quote for 12-((-5-Iodo-4-azido-2-hydroxybenzoyl)amino)dodecanoic acid cholesteryl ester directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 12-((-5-Iodo-4-azido-2-hydroxybenzoyl)amino)dodecanoic acid cholesteryl ester?
Yes, CoreyChem provides custom synthesis services for 12-((-5-Iodo-4-azido-2-hydroxybenzoyl)amino)dodecanoic acid cholesteryl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.