TMDHCAN cpd
TL;DR: TMDHCAN cpd (CAS 270902-51-7) is a chemical compound with molecular formula C25H42N2O8 and molecular weight 498.29 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(3R,6S)-7-oxo-6-[[(E,2R,3R,4S,5R)-3,4,5-trihydroxy-2-methoxy-8,8-dimethylnon-6-enoyl]amino]azepan-3-yl] cyclohexanecarboxylate
Also Known As: TMDHCAN cpd, LAF389, starbld0025903, NVP-LAF-389, LAF 389
| Molecular Formula | C25H42N2O8 |
|---|---|
| Molecular Weight | 498.29 g/mol |
| LogP | 0.5733 |
| Topological Polar Surface Area | 154.42 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 9 |
| Exact Mass | 498.29413 |
| Heavy Atoms | 35 |
| Complexity | 744.2391 |
Chemical Identifiers
| CAS Number | 270902-51-7 |
|---|---|
| SMILES | CC(C)(C)/C=C/[C@H]([C@@H]([C@H]([C@H](C(=O)N[C@H]1CC[C@H](CNC1=O)OC(=O)C2CCCCC2)OC)O)O)O |
Product Overview
TMDHCAN cpd (CAS 270902-51-7), with molecular formula C25H42N2O8 and molecular weight 498.29 g/mol. IUPAC: [(3R,6S)-7-oxo-6-[[(E,2R,3R,4S,5R)-3,4,5-trihydroxy-2-methoxy-8,8-dimethylnon-6-enoyl]amino]azepan-3-yl] cyclohexanecarboxylate.
Chemical Property Profile of TMDHCAN cpd
Property Insights of TMDHCAN cpd
The XLogP value of 0.5733 suggests moderate lipophilicity, balancing water solubility and membrane permeability for TMDHCAN cpd. The TPSA of 154.42 Ų indicates high polarity, suggesting TMDHCAN cpd may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, TMDHCAN cpd has 5 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of TMDHCAN cpd?
The CAS number of TMDHCAN cpd is 270902-51-7.
What is the molecular formula of TMDHCAN cpd?
The molecular formula of TMDHCAN cpd is C25H42N2O8.
What is the molecular weight of TMDHCAN cpd?
The molecular weight of TMDHCAN cpd is 498.29 g/mol.
Where can I buy TMDHCAN cpd?
You can request a quote for TMDHCAN cpd directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for TMDHCAN cpd?
Yes, KEHONG BIO provides custom synthesis services for TMDHCAN cpd and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.