u-83836e
TL;DR: u-83836e (CAS 122003-11-6) is a chemical compound with molecular formula C30H44N6O2 and molecular weight 520.35 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[4-(2,6-dipyrrolidin-1-ylpyrimidin-4-yl)piperazin-1-yl]methyl]-2,5,7,8-tetramethyl-3,4-dihydrochromen-6-ol
Also Known As: u-83836e, U-83836 dihydrochloride, Lopac0_001225, SMP2_000285, U-78517F
| Molecular Formula | C30H44N6O2 |
|---|---|
| Molecular Weight | 520.35 g/mol |
| LogP | 5.4 |
| Topological Polar Surface Area | 68.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 5 |
| Exact Mass | 520.3526 |
| Heavy Atoms | 38 |
| Complexity | 783.0 |
Chemical Identifiers
| CAS Number | 122003-11-6 |
|---|---|
| SMILES | CC1=C(C2=C(CCC(O2)(C)CN3CCN(CC3)C4=NC(=NC(=C4)N5CCCC5)N6CCCC6)C(=C1O)C)C |
| InChIKey | KPZQRBACZSLMPH-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
u-83836e (CAS 122003-11-6), with molecular formula C30H44N6O2 and molecular weight 520.35 g/mol. IUPAC: 2-[[4-(2,6-dipyrrolidin-1-ylpyrimidin-4-yl)piperazin-1-yl]methyl]-2,5,7,8-tetramethyl-3,4-dihydrochromen-6-ol.
Chemical Property Profile of u-83836e
Property Insights of u-83836e
The XLogP value of 5.4 indicates that u-83836e is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 68.2 Ų falls within the moderate polarity range, balancing permeability and solubility for u-83836e. Following Lipinski's Rule of Five, u-83836e has 1 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of u-83836e?
The CAS number of u-83836e is 122003-11-6.
What is the molecular formula of u-83836e?
The molecular formula of u-83836e is C30H44N6O2.
What is the molecular weight of u-83836e?
The molecular weight of u-83836e is 520.35 g/mol.
Where can I buy u-83836e?
You can request a quote for u-83836e directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for u-83836e?
Yes, KEHONG BIO provides custom synthesis services for u-83836e and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.