RefChem:381077
TL;DR: RefChem:381077 (CAS 27922-08-3) is a chemical compound with molecular formula C17H29ClN2O4 and molecular weight 360.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(dimethylamino)ethyl (4'aS,8'aS)-2-oxospiro[1,3-oxazolidine-5,7'-2,3,4,4a,5,6,8,8a-octahydro-1H-naphthalene]-3-carboxylate;hydrochloride
Also Known As: Spiro(decahydronaphthalene-2,5'-oxazolidine)-3'-carboxylic acid, 2'-oxo-, 2-dimethylaminoethyl ester, hydrochloride, (trans,cis), 2-(dimethylamino)ethyl(4as,8as)-2'-oxooctahydro-1h,3'h-spiro[naphthalene-2,5'-[1,3]oxazolidine]-3'-carboxylate hydrochloride(1:1), 2-(Dimethylamino)ethyl (4aS,8aS)-2'-oxooctahydro-1H-spiro[naphthalene-2,5'-[1,3]oxazolidine]-3'-carboxylate--hydrogen chloride (1/1), 2-(Dimethylamino)ethyl 2'-oxooctahydro-1H-spiro[naphthalene-2,5'-[1,3]oxazolidine]-3'-carboxylate--hydrogen chloride (1/1), 2-dimethylaminoethyl (4'aS,8'aS)-2-oxospiro[1,3-oxazolidine-5,7'-2,3,4,4a,5,6,8,8a-octahydro-1H-naphthalene]-3-carboxylate hydrochloride
| Molecular Formula | C17H29ClN2O4 |
|---|---|
| Molecular Weight | 360.18 g/mol |
| LogP | 3.2877 |
| Topological Polar Surface Area | 59.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 360.18158 |
| Heavy Atoms | 24 |
| Complexity | 468.0 |
Chemical Identifiers
| CAS Number | 27922-08-3 |
|---|---|
| SMILES | CN(C)CCOC(=O)N1CC2(CC[C@@H]3CCCC[C@H]3C2)OC1=O.Cl |
| InChIKey | ISGLOQXSGHDUFE-CCPPVWQFSA-N |
Product Overview
RefChem:381077 (CAS 27922-08-3), with molecular formula C17H29ClN2O4 and molecular weight 360.18 g/mol. IUPAC: 2-(dimethylamino)ethyl (4'aS,8'aS)-2-oxospiro[1,3-oxazolidine-5,7'-2,3,4,4a,5,6,8,8a-octahydro-1H-naphthalene]-3-carboxylate;hydrochloride.
Chemical Property Profile of RefChem:381077
Property Insights of RefChem:381077
The XLogP value of 3.2877 indicates that RefChem:381077 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 59.1 Ų, RefChem:381077 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:381077 has 1 hydrogen bond donor(s) and 5 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:381077?
The CAS number of RefChem:381077 is 27922-08-3.
What is the molecular formula of RefChem:381077?
The molecular formula of RefChem:381077 is C17H29ClN2O4.
What is the molecular weight of RefChem:381077?
The molecular weight of RefChem:381077 is 360.18 g/mol.
Where can I buy RefChem:381077?
You can request a quote for RefChem:381077 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:381077?
Yes, KEHONG BIO provides custom synthesis services for RefChem:381077 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.