CLL1_001374
TL;DR: CLL1_001374 (CAS 5199-53-1) is a chemical compound with molecular formula C51H70N2O7 and molecular weight 822.52 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[4-hydroxy-15,16-bis(4-hydroxybutyl)-12-methoxyimino-9-prop-2-enoxy-8-oxatetracyclo[7.7.1.02,7.013,17]heptadeca-2(7),3,5,13-tetraen-10-yl]-N-(naphthalen-1-ylmethyl)dodecanamide
Also Known As: CLL1_001374, N-{10-Hydroxy-1,2-bis(4-hydroxybutyl)-4-(methoxyimino)-6a-[(prop-2-en-1-yl)oxy]-1,2,4,5,6,6a,11b,11c-octahydrobenzo[kl]xanthen-6-yl}-N-[(naphthalen-1-yl)methyl]dodecanamide
| Molecular Formula | C51H70N2O7 |
|---|---|
| Molecular Weight | 822.52 g/mol |
| LogP | 10.7585 |
| Topological Polar Surface Area | 121.05 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 25 |
| Exact Mass | 822.5183 |
| Heavy Atoms | 60 |
| Complexity | 1903.762 |
Chemical Identifiers
| CAS Number | 5199-53-1 |
|---|---|
| SMILES | CCCCCCCCCCCC(=O)N(CC1=CC=CC2=CC=CC=C21)C3CC(=NOC)C4=CC(C(C5C4C3(OC6=C5C=C(C=C6)O)OCC=C)CCCCO)CCCCO |
Product Overview
CLL1_001374 (CAS 5199-53-1), with molecular formula C51H70N2O7 and molecular weight 822.52 g/mol. IUPAC: N-[4-hydroxy-15,16-bis(4-hydroxybutyl)-12-methoxyimino-9-prop-2-enoxy-8-oxatetracyclo[7.7.1.02,7.013,17]heptadeca-2(7),3,5,13-tetraen-10-yl]-N-(naphthalen-1-ylmethyl)dodecanamide.
Chemical Property Profile of CLL1_001374
Property Insights of CLL1_001374
The XLogP value of 10.7585 indicates that CLL1_001374 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 121.05 Ų falls within the moderate polarity range, balancing permeability and solubility for CLL1_001374. Following Lipinski's Rule of Five, CLL1_001374 has 3 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_001374?
The CAS number of CLL1_001374 is 5199-53-1.
What is the molecular formula of CLL1_001374?
The molecular formula of CLL1_001374 is C51H70N2O7.
What is the molecular weight of CLL1_001374?
The molecular weight of CLL1_001374 is 822.52 g/mol.
Where can I buy CLL1_001374?
You can request a quote for CLL1_001374 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for CLL1_001374?
Yes, KEHONG BIO provides custom synthesis services for CLL1_001374 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.