Einecs 265-936-6
TL;DR: Einecs 265-936-6 (CAS 65826-02-0) is a chemical compound with molecular formula C27H37N2O11P and molecular weight 596.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl (15S,19S)-15-ethyl-1,11-diazapentacyclo[9.6.2.02,7.08,18.015,19]nonadeca-2,4,6,8(18),16-pentaene-17-carboxylate;[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl] dihydrogen phosphate
Also Known As: EINECS 265-936-6, Methyl (3alpha,16alpha)-eburnamenine-14-carboxylate, compound withalpha-D-glucopyranose 1-(dihydrogen phosphate) (1:1), Methyl eburnamenine-14-carboxylate--1-O-phosphonohexopyranose (1/1), Methyl 3alpha,16alpha-eburnamenine-14-carboxylate--1-O-phosphono-beta-D-glucopyranose (1/1), Methyl(3alpha,16alpha)-eburnamenine-14-carboxylate,compound withalpha-D-glucopyranose 1-(dihydrogen phosphate)(1:1)
| Molecular Formula | C27H37N2O11P |
|---|---|
| Molecular Weight | 596.21 g/mol |
| LogP | 0.6538 |
| Topological Polar Surface Area | 191.38 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 5 |
| Exact Mass | 596.2135 |
| Heavy Atoms | 41 |
| Complexity | 1370.4645 |
Chemical Identifiers
| CAS Number | 65826-02-0 |
|---|---|
| SMILES | CC[C@@]12CCCN3[C@@H]1C4=C(CC3)C5=CC=CC=C5N4C(=C2)C(=O)OC.C([C@@H]1[C@H]([C@@H]([C@H]([C@@H](O1)OP(=O)(O)O)O)O)O)O |
Product Overview
Einecs 265-936-6 (CAS 65826-02-0), with molecular formula C27H37N2O11P and molecular weight 596.21 g/mol. IUPAC: methyl (15S,19S)-15-ethyl-1,11-diazapentacyclo[9.6.2.02,7.08,18.015,19]nonadeca-2,4,6,8(18),16-pentaene-17-carboxylate;[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl] dihydrogen phosphate.
Chemical Property Profile of Einecs 265-936-6
Property Insights of Einecs 265-936-6
The XLogP value of 0.6538 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Einecs 265-936-6. The TPSA of 191.38 Ų indicates high polarity, suggesting Einecs 265-936-6 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Einecs 265-936-6 has 6 hydrogen bond donor(s) and 10 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Einecs 265-936-6?
The CAS number of Einecs 265-936-6 is 65826-02-0.
What is the molecular formula of Einecs 265-936-6?
The molecular formula of Einecs 265-936-6 is C27H37N2O11P.
What is the molecular weight of Einecs 265-936-6?
The molecular weight of Einecs 265-936-6 is 596.21 g/mol.
Where can I buy Einecs 265-936-6?
You can request a quote for Einecs 265-936-6 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Einecs 265-936-6?
Yes, KEHONG BIO provides custom synthesis services for Einecs 265-936-6 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.