Aipp-EM
TL;DR: Aipp-EM (CAS 159899-37-3) is a chemical compound with molecular formula C35H43Cl2IN6O5 and molecular weight 822.1718 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[(8R,9S,13S,14S,17S)-17-[2-[3-(4-azido-3-(125I)iodophenyl)propanoylamino]ethylcarbamoyloxy]-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-3-yl] N,N-bis(2-chloroethyl)carbamate
Also Known As: Aipp-EM, 17-O-((2-(3-(4-Azido-3-iodophenyl)propionamido)ethyl)carbamyl)estradiol-3-N-bis(chloroethyl)carbamate, [(8R,9S,13S,14S,17S)-17-[2-[3-(4-azido-3-iodanylphenyl)propanoylamino]ethylcarbamoyloxy]-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-3-yl] N,N-bis(2-chloroethyl)carbamate, (1S,3aS,3bR,9bS,11aS)-1-{[(2-{3-[4-azido-3-(125I)iodophenyl]propanamido}ethyl)carbamoyl]oxy}-11a-methyl-1H,2H,3H,3aH,3bH,4H,5H,9bH,10H,11H,11aH-cyclopenta[a]phenanthren-7-yl N,N-bis(2-chloroethyl)carbamate, (1S,3aS,3bR,9bS,11aS)-7-{[Bis(2-chloroethyl)carbamoyl]oxy}-11a-methyl-2,3,3a,3b,4,5,9b,10,11,11a-decahydro-1H-cyclopenta[a]phenanthren-1-yl (2-{3-[4-azido-3-(~125~I)iodophenyl]propanamido}ethyl)carbamate
Technical Specifications
| Molecular Formula | C35H43Cl2IN6O5 |
| Molecular Weight | 822.1718 g/mol |
| XLogP | 8.4 |
| Topological Polar Surface Area (TPSA) | 111.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 15 |
| Exact Mass | 822.1718 Da |
| Heavy Atoms | 49 |
| Complexity | 1190.0 |
| SMILES | C[C@]12CC[C@H]3[C@H]([C@@H]1CC[C@@H]2OC(=O)NCCNC(=O)CCC4=CC(=C(C=C4)N=[N+]=[N-])[125I])CCC5=C3C=CC(=C5)OC(=O)N(CCCl)CCCl |
| InChIKey | YYDIMLLAANCLAT-SMLQHYSKSA-N |
Chemical Property Profile of Aipp-EM
Property Insights of Aipp-EM
The XLogP value of 8.4 indicates that Aipp-EM is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 111.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Aipp-EM. Following Lipinski's Rule of Five, Aipp-EM has 2 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of Aipp-EM?
The CAS number of Aipp-EM is 159899-37-3.
What is the molecular formula of Aipp-EM?
The molecular formula of Aipp-EM is C35H43Cl2IN6O5.
What is the molecular weight of Aipp-EM?
The molecular weight of Aipp-EM is 822.1718 g/mol.
Where can I buy Aipp-EM?
You can request a quote for Aipp-EM directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Aipp-EM?
Yes, CoreyChem provides custom synthesis services for Aipp-EM and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.