RefChem:204359
TL;DR: RefChem:204359 (CAS 67069-39-0) is a chemical compound with molecular formula C19H28N2O4 and molecular weight 348.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3S,11bR)-N,N-diethyl-9,10-dimethoxy-1,3,4,6,7,11b-hexahydro-[1,4]oxazino[3,4-a]isoquinoline-3-carboxamide
Also Known As: N,N-Diethyl-1,3,4,6,7,11b-hexahydro-(1,4)oxazino(3,4-a)isoquinoline-3-carboxamide, (1,4)Oxazino(3,4-a)isoquinoline-3-carboxamide, N,N-diethyl-1,3,4,6,7,11b-hexahydro-9,9,10-dimethoxy-, trans-, trans-N,N-Diethyl-1,3,4,6,7,11b-hexahydro-9,9,10-dimethoxy-(1,4)oxazino[3,4-a]isoquinoline-3-carboxamide, (3S,11bR)-N,N-diethyl-9,10-dimethoxy-1,3,4,6,7,11b-hexahydro-[1,4]oxazino[3,4-a]isoquinoline-3-carboxamide, (3S,11bR)-N,N-Diethyl-9,10-dimethoxy-1,3,4,6,7,11b-hexahydro[1,4]oxazino[3,4-a]isoquinoline-3-carboxamide
| Molecular Formula | C19H28N2O4 |
|---|---|
| Molecular Weight | 348.20 g/mol |
| LogP | 1.7 |
| Topological Polar Surface Area | 51.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 348.2049 |
| Heavy Atoms | 25 |
| Complexity | 457.0 |
Chemical Identifiers
| CAS Number | 67069-39-0 |
|---|---|
| SMILES | CCN(CC)C(=O)[C@@H]1CN2CCC3=CC(=C(C=C3[C@@H]2CO1)OC)OC |
| InChIKey | LCOQCSWRNWGOIT-YJBOKZPZSA-N |
Product Overview
RefChem:204359 (CAS 67069-39-0), with molecular formula C19H28N2O4 and molecular weight 348.20 g/mol. IUPAC: (3S,11bR)-N,N-diethyl-9,10-dimethoxy-1,3,4,6,7,11b-hexahydro-[1,4]oxazino[3,4-a]isoquinoline-3-carboxamide.
Chemical Property Profile of RefChem:204359
Property Insights of RefChem:204359
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:204359. With a topological polar surface area (TPSA) of 51.2 Ų, RefChem:204359 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:204359 has 0 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:204359?
The CAS number of RefChem:204359 is 67069-39-0.
What is the molecular formula of RefChem:204359?
The molecular formula of RefChem:204359 is C19H28N2O4.
What is the molecular weight of RefChem:204359?
The molecular weight of RefChem:204359 is 348.20 g/mol.
Where can I buy RefChem:204359?
You can request a quote for RefChem:204359 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:204359?
Yes, KEHONG BIO provides custom synthesis services for RefChem:204359 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.