RD 4-2138
TL;DR: RD 4-2138 (CAS 76663-53-1) is a chemical compound with molecular formula C38H60O8 and molecular weight 644.43 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(1S,4S,5S,6R,9S,10R,12S,14R)-4-(2,3-dimethylbutanoyloxy)-5,6-dihydroxy-7-(hydroxymethyl)-3,11,11,14-tetramethyl-15-oxo-12-tetracyclo[7.5.1.01,5.010,12]pentadeca-2,7-dienyl] dodecanoate
Also Known As: RD4-2138, RD 4-2138, 13-Hydroxyingenol-3-(2,3-dimethylbutanoate)-13-dodecanoate, RD-4-2138, J1.010.944B
| Molecular Formula | C38H60O8 |
|---|---|
| Molecular Weight | 644.43 g/mol |
| LogP | 7.1 |
| Topological Polar Surface Area | 130.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 17 |
| Exact Mass | 644.42883 |
| Heavy Atoms | 46 |
| Complexity | 1220.0 |
Chemical Identifiers
| CAS Number | 76663-53-1 |
|---|---|
| SMILES | CCCCCCCCCCCC(=O)O[C@@]12C[C@H]([C@]34C=C([C@@H]([C@]3([C@@H](C(=C[C@@H]([C@@H]1C2(C)C)C4=O)CO)O)O)OC(=O)C(C)C(C)C)C)C |
| InChIKey | HAZRIGCVIAWJTI-YKEFVAIKSA-N |
Product Overview
RD 4-2138 (CAS 76663-53-1), with molecular formula C38H60O8 and molecular weight 644.43 g/mol. IUPAC: [(1S,4S,5S,6R,9S,10R,12S,14R)-4-(2,3-dimethylbutanoyloxy)-5,6-dihydroxy-7-(hydroxymethyl)-3,11,11,14-tetramethyl-15-oxo-12-tetracyclo[7.5.1.01,5.010,12]pentadeca-2,7-dienyl] dodecanoate.
Chemical Property Profile of RD 4-2138
Property Insights of RD 4-2138
The XLogP value of 7.1 indicates that RD 4-2138 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 130.0 Ų falls within the moderate polarity range, balancing permeability and solubility for RD 4-2138. Following Lipinski's Rule of Five, RD 4-2138 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 RD 4-2138?
The CAS number of RD 4-2138 is 76663-53-1.
What is the molecular formula of RD 4-2138?
The molecular formula of RD 4-2138 is C38H60O8.
What is the molecular weight of RD 4-2138?
The molecular weight of RD 4-2138 is 644.43 g/mol.
Where can I buy RD 4-2138?
You can request a quote for RD 4-2138 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RD 4-2138?
Yes, KEHONG BIO provides custom synthesis services for RD 4-2138 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.