(-)-Delavaine
TL;DR: (-)-Delavaine (CAS 27989-72-6) is a chemical compound with molecular formula C20H23NO5 and molecular weight 357.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(1S,12S)-3,16-dimethoxy-20-methyl-5,7-dioxa-20-azapentacyclo[10.5.3.01,13.02,10.04,8]icosa-2,4(8),9,16-tetraen-15-one
Also Known As: Delavaine, (-)-delavaine
| Molecular Formula | C20H23NO5 |
|---|---|
| Molecular Weight | 357.16 g/mol |
| LogP | 2.0412 |
| Topological Polar Surface Area | 57.23 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 357.15762 |
| Heavy Atoms | 26 |
| Complexity | 831.9807 |
Chemical Identifiers
| CAS Number | 27989-72-6 |
|---|---|
| SMILES | CN1CC[C@@]23C=C(C(=O)CC2[C@@H]1CC4=CC5=C(C(=C34)OC)OCO5)OC |
Product Overview
(-)-Delavaine (CAS 27989-72-6), with molecular formula C20H23NO5 and molecular weight 357.16 g/mol. IUPAC: (1S,12S)-3,16-dimethoxy-20-methyl-5,7-dioxa-20-azapentacyclo[10.5.3.01,13.02,10.04,8]icosa-2,4(8),9,16-tetraen-15-one.
Chemical Property Profile of (-)-Delavaine
Property Insights of (-)-Delavaine
The XLogP value of 2.0412 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (-)-Delavaine. With a topological polar surface area (TPSA) of 57.23 Ų, (-)-Delavaine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (-)-Delavaine has 0 hydrogen bond donor(s) and 6 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 (-)-Delavaine?
The CAS number of (-)-Delavaine is 27989-72-6.
What is the molecular formula of (-)-Delavaine?
The molecular formula of (-)-Delavaine is C20H23NO5.
What is the molecular weight of (-)-Delavaine?
The molecular weight of (-)-Delavaine is 357.16 g/mol.
Where can I buy (-)-Delavaine?
You can request a quote for (-)-Delavaine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (-)-Delavaine?
Yes, KEHONG BIO provides custom synthesis services for (-)-Delavaine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.