U-73122
TL;DR: U-73122 (CAS 112648-68-7) is a chemical compound with molecular formula C29H40N2O3 and molecular weight 464.30 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[6-[(3-methoxy-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-17-yl)amino]hexyl]pyrrole-2,5-dione
Also Known As: U-73122, 1-[6-[(3-methoxy-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-17-yl)amino]hexyl]pyrrole-2,5-dione, 1-(6-[(17 beta-3-Methoxyestra-1,3,5-(10)-trien-17-yl)amino]hexyl)-1H-pyrrole-2,5-dione, 1-(6-((17beta-3-methoxyestra-1,3,5(10)-trien-17-yl)amino)hexyl)-1h-pyrrole-2,5-dione, 1-(6-((3-Methoxyestra-1,3,5(10)-trien-17-yl)amino)hexyl)-1H-pyrrole-2,5-dione
| Molecular Formula | C29H40N2O3 |
|---|---|
| Molecular Weight | 464.30 g/mol |
| LogP | 4.0 |
| Topological Polar Surface Area | 58.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 9 |
| Exact Mass | 464.3039 |
| Heavy Atoms | 34 |
| Complexity | 763.0 |
Chemical Identifiers
| CAS Number | 112648-68-7 |
|---|---|
| SMILES | CC12CCC3C(C1CCC2NCCCCCCN4C(=O)C=CC4=O)CCC5=C3C=CC(=C5)OC |
| InChIKey | LUFAORPFSVMJIW-UHFFFAOYSA-N |
Product Overview
U-73122 (CAS 112648-68-7), with molecular formula C29H40N2O3 and molecular weight 464.30 g/mol. IUPAC: 1-[6-[(3-methoxy-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-17-yl)amino]hexyl]pyrrole-2,5-dione.
Chemical Property Profile of U-73122
Property Insights of U-73122
The XLogP value of 4.0 indicates that U-73122 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 58.6 Ų, U-73122 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, U-73122 has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of U-73122?
The CAS number of U-73122 is 112648-68-7.
What is the molecular formula of U-73122?
The molecular formula of U-73122 is C29H40N2O3.
What is the molecular weight of U-73122?
The molecular weight of U-73122 is 464.30 g/mol.
Where can I buy U-73122?
You can request a quote for U-73122 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for U-73122?
Yes, KEHONG BIO provides custom synthesis services for U-73122 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.