RefChem:1056158
TL;DR: RefChem:1056158 (CAS 24191-83-1) is a chemical compound with molecular formula C19H30N2O8 and molecular weight 414.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-but-2-enedioic acid;2-(dimethylamino)ethyl (7R,9S)-7,9-dimethyl-2-oxo-1-oxa-3-azaspiro[4.5]decane-3-carboxylate
Also Known As: Dimethylaminoethyl 7,9-dimethyl-2-oxo-1-oxa-3-azaspiro(4.5)decane-3-carboxylate fumarate, 1-Oxa-3-azaspiro(4.5)decane-3-carboxylic acid, 7,9-dimethyl-2-oxo-, 2-(dimethylamino)ethyl ester, fumarate, hydrate, (Z)-, (5R,7S,9R)-7,9-Dimethyl-2-oxo-1-oxa-3-aza-spiro[4.5]decane-3-carboxylic acid 2-dimethylamino-ethyl ester, (E)-but-2-enedioic acid; 2-dimethylaminoethyl (7R,9S)-7,9-dimethyl-3-oxo-4-oxa-2-azaspiro[4.5]decane-2-carboxylate, 7t,9t-dimethyl-2-oxo-(5rO)-1-oxa-3-aza-spiro[4.5]decane-3-carboxylic acid 2-dimethylamino-ethyl ester, fumarate (1:1)
| Molecular Formula | C19H30N2O8 |
|---|---|
| Molecular Weight | 414.20 g/mol |
| LogP | 2.0435 |
| Topological Polar Surface Area | 133.68 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 414.20023 |
| Heavy Atoms | 29 |
| Complexity | 620.1204 |
Chemical Identifiers
| CAS Number | 24191-83-1 |
|---|---|
| SMILES | C[C@@H]1C[C@@H](CC2(C1)CN(C(=O)O2)C(=O)OCCN(C)C)C.C(=C/C(=O)O)\C(=O)O |
Product Overview
RefChem:1056158 (CAS 24191-83-1), with molecular formula C19H30N2O8 and molecular weight 414.20 g/mol. IUPAC: (E)-but-2-enedioic acid;2-(dimethylamino)ethyl (7R,9S)-7,9-dimethyl-2-oxo-1-oxa-3-azaspiro[4.5]decane-3-carboxylate.
Chemical Property Profile of RefChem:1056158
Property Insights of RefChem:1056158
The XLogP value of 2.0435 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:1056158. The TPSA of 133.68 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:1056158. Following Lipinski's Rule of Five, RefChem:1056158 has 2 hydrogen bond donor(s) and 7 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 RefChem:1056158?
The CAS number of RefChem:1056158 is 24191-83-1.
What is the molecular formula of RefChem:1056158?
The molecular formula of RefChem:1056158 is C19H30N2O8.
What is the molecular weight of RefChem:1056158?
The molecular weight of RefChem:1056158 is 414.20 g/mol.
Where can I buy RefChem:1056158?
You can request a quote for RefChem:1056158 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:1056158?
Yes, KEHONG BIO provides custom synthesis services for RefChem:1056158 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.