RefChem:357465
TL;DR: RefChem:357465 (CAS 74037-65-3) is a chemical compound with molecular formula C31H42N2O16 and molecular weight 698.25 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4R,4aR,7aR,12bS)-3-methyl-9-(2-morpholin-4-ylethoxy)-1,2,4,4a,5,6,7a,13-octahydro-4,12-methanobenzofuro[3,2-e]isoquinolin-7-one;bis((2R,3R)-2,3-dihydroxybutanedioic acid)
Also Known As: Morhinone, dihydro-O3-2-morpholinoethyl-, ditartrate, 3-Morpholylaethyl-dihydro-morphinon (bis-hydrogentartrat), 3-Morpholylaethyl-dihydro-morphinon (bis-hydrogentartrat) [German], Morphinan-6-one, 4,5-epoxy-17-methyl-3-(2-(4-morpholinyl)ethoxy)-, (5-alpha)-, (2R,3R)-2,3-dihydroxybutanedioate (1:2), 4,5-alpha-Epoxy-17-methyl-3-(2-morpholinoethoxy)morphinan-6-alpha-one bis(hydrogentartrate)
| Molecular Formula | C31H42N2O16 |
|---|---|
| Molecular Weight | 698.25 g/mol |
| LogP | -2.6095 |
| Topological Polar Surface Area | 281.36 Ų |
| Hydrogen Bond Donors | 8 |
| Hydrogen Bond Acceptors | 14 |
| Rotatable Bonds | 10 |
| Exact Mass | 698.2534 |
| Heavy Atoms | 49 |
| Complexity | 1343.825 |
Chemical Identifiers
| CAS Number | 74037-65-3 |
|---|---|
| SMILES | CN1CC[C@]23[C@@H]4[C@H]1CC5=C2C(=C(C=C5)OCCN6CCOCC6)O[C@H]3C(=O)CC4.[C@@H]([C@H](C(=O)O)O)(C(=O)O)O.[C@@H]([C@H](C(=O)O)O)(C(=O)O)O |
Product Overview
RefChem:357465 (CAS 74037-65-3), with molecular formula C31H42N2O16 and molecular weight 698.25 g/mol. IUPAC: (4R,4aR,7aR,12bS)-3-methyl-9-(2-morpholin-4-ylethoxy)-1,2,4,4a,5,6,7a,13-octahydro-4,12-methanobenzofuro[3,2-e]isoquinolin-7-one;bis((2R,3R)-2,3-dihydroxybutanedioic acid).
Chemical Property Profile of RefChem:357465
Property Insights of RefChem:357465
The XLogP value of -2.6095 indicates that RefChem:357465 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 281.36 Ų indicates high polarity, suggesting RefChem:357465 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, RefChem:357465 has 8 hydrogen bond donor(s) and 14 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of RefChem:357465?
The CAS number of RefChem:357465 is 74037-65-3.
What is the molecular formula of RefChem:357465?
The molecular formula of RefChem:357465 is C31H42N2O16.
What is the molecular weight of RefChem:357465?
The molecular weight of RefChem:357465 is 698.25 g/mol.
Where can I buy RefChem:357465?
You can request a quote for RefChem:357465 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:357465?
Yes, KEHONG BIO provides custom synthesis services for RefChem:357465 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.