Nostocyclophane D
TL;DR: Nostocyclophane D (CAS 126693-93-4) is a chemical compound with molecular formula C36H54Cl2O6 and molecular weight 652.33 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2R,4R,8S,13R,15R,19S)-8,19-dibutyl-4,15-dichloro-2,13-dimethoxytricyclo[18.2.2.29,12]hexacosa-1(22),9,11,20,23,25-hexaene-10,21,24,26-tetrol
Also Known As: Nostocyclophane D, 2,4,6-Trimethyl-3-heptene, (2R,4R,8S,13R,15R,19S)-8,19-dibutyl-4,15-dichloro-2,13-dimethoxytricyclo[18.2.2.29,12]hexacosa-1(22),9,11,20,23,25-hexaene-10,21,24,26-tetrol, (2R,4R,8S,13R,15R,19S)-8,19-Dibutyl-4,15-dichloro-2,13-dimethoxytricyclo[18.2.2.29,12]hexacosa-9,11,, (2R,4R,8S,13R,15R,19S)-8,19-dibutyl-4,15-dichloro-2,13-dimethoxytricyclo(18.2.2.29,12)hexacosa-1(22),9,11,20,23,25-hexaene-10,21,24,26-tetrol
| Molecular Formula | C36H54Cl2O6 |
|---|---|
| Molecular Weight | 652.33 g/mol |
| LogP | 10.481 |
| Topological Polar Surface Area | 99.38 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 652.3298 |
| Heavy Atoms | 44 |
| Complexity | 1021.9315 |
Chemical Identifiers
| CAS Number | 126693-93-4 |
|---|---|
| SMILES | CCCC[C@H]1CCC[C@H](C[C@H](C2=CC(=C([C@H](CCC[C@H](C[C@H](C3=CC(=C1C(=C3)O)O)OC)Cl)CCCC)C(=C2)O)O)OC)Cl |
Product Overview
Nostocyclophane D (CAS 126693-93-4), with molecular formula C36H54Cl2O6 and molecular weight 652.33 g/mol. IUPAC: (2R,4R,8S,13R,15R,19S)-8,19-dibutyl-4,15-dichloro-2,13-dimethoxytricyclo[18.2.2.29,12]hexacosa-1(22),9,11,20,23,25-hexaene-10,21,24,26-tetrol.
Chemical Property Profile of Nostocyclophane D
Property Insights of Nostocyclophane D
The XLogP value of 10.481 indicates that Nostocyclophane D is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 99.38 Ų falls within the moderate polarity range, balancing permeability and solubility for Nostocyclophane D. Following Lipinski's Rule of Five, Nostocyclophane D has 4 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Nostocyclophane D?
The CAS number of Nostocyclophane D is 126693-93-4.
What is the molecular formula of Nostocyclophane D?
The molecular formula of Nostocyclophane D is C36H54Cl2O6.
What is the molecular weight of Nostocyclophane D?
The molecular weight of Nostocyclophane D is 652.33 g/mol.
Where can I buy Nostocyclophane D?
You can request a quote for Nostocyclophane D directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Nostocyclophane D?
Yes, KEHONG BIO provides custom synthesis services for Nostocyclophane D and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.