CLL1_002876
TL;DR: CLL1_002876 (CAS 5202-41-5) is a chemical compound with molecular formula C58H82N2O7 and molecular weight 918.61 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[15,16-bis(4-hydroxybutyl)-12-[(2-methylpropan-2-yl)oxyimino]-4-(4-phenylphenoxy)-9-prop-2-enoxy-8-oxatetracyclo[7.7.1.02,7.013,17]heptadeca-2(7),3,5,13-tetraen-10-yl]-N-propyldodecanamide
Also Known As: CLL1_002876, N-{10-[([1,1'-Biphenyl]-4-yl)oxy]-4-(tert-butoxyimino)-1,2-bis(4-hydroxybutyl)-6a-[(prop-2-en-1-yl)oxy]-1,2,4,5,6,6a,11b,11c-octahydrobenzo[kl]xanthen-6-yl}-N-propyldodecanamide
| Molecular Formula | C58H82N2O7 |
|---|---|
| Molecular Weight | 918.61 g/mol |
| LogP | 13.7375 |
| Topological Polar Surface Area | 110.05 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 28 |
| Exact Mass | 918.6122 |
| Heavy Atoms | 67 |
| Complexity | 2041.3896 |
Chemical Identifiers
| CAS Number | 5202-41-5 |
|---|---|
| SMILES | CCCCCCCCCCCC(=O)N(CCC)C1CC(=NOC(C)(C)C)C2=CC(C(C3C2C1(OC4=C3C=C(C=C4)OC5=CC=C(C=C5)C6=CC=CC=C6)OCC=C)CCCCO)CCCCO |
Product Overview
CLL1_002876 (CAS 5202-41-5), with molecular formula C58H82N2O7 and molecular weight 918.61 g/mol. IUPAC: N-[15,16-bis(4-hydroxybutyl)-12-[(2-methylpropan-2-yl)oxyimino]-4-(4-phenylphenoxy)-9-prop-2-enoxy-8-oxatetracyclo[7.7.1.02,7.013,17]heptadeca-2(7),3,5,13-tetraen-10-yl]-N-propyldodecanamide.
Chemical Property Profile of CLL1_002876
Property Insights of CLL1_002876
The XLogP value of 13.7375 indicates that CLL1_002876 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 110.05 Ų falls within the moderate polarity range, balancing permeability and solubility for CLL1_002876. Following Lipinski's Rule of Five, CLL1_002876 has 2 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 CLL1_002876?
The CAS number of CLL1_002876 is 5202-41-5.
What is the molecular formula of CLL1_002876?
The molecular formula of CLL1_002876 is C58H82N2O7.
What is the molecular weight of CLL1_002876?
The molecular weight of CLL1_002876 is 918.61 g/mol.
Where can I buy CLL1_002876?
You can request a quote for CLL1_002876 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for CLL1_002876?
Yes, KEHONG BIO provides custom synthesis services for CLL1_002876 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.