多花水仙碱
TL;DR: 多花水仙碱 (CAS 507-79-9) is a chemical compound with molecular formula C18H21NO5 and molecular weight 331.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
多花水仙碱
(1S,13R,16S,18S)-18-methoxy-15-methyl-5,7,12-trioxa-15-azapentacyclo[11.7.0.01,16.02,10.04,8]icosa-2,4(8),9,19-tetraen-13-ol
Also Known As: Tazettine, Sekisanin, Sekisanolin, Sekisanine, Sekisanoline
| Molecular Formula | C18H21NO5 |
|---|---|
| Molecular Weight | 331.14 g/mol |
| LogP | 1.0 |
| Topological Polar Surface Area | 60.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 1 |
| Exact Mass | 331.14197 |
| Heavy Atoms | 24 |
| Complexity | 556.0 |
Chemical Identifiers
| CAS Number | 507-79-9 |
|---|---|
| SMILES | CN1C[C@]2([C@]3([C@@H]1C[C@@H](C=C3)OC)C4=CC5=C(C=C4CO2)OCO5)O |
| InChIKey | YLWAQARRNQVEHD-IEGACIPQSA-N |
Product Overview
多花水仙碱 (CAS 507-79-9), with molecular formula C18H21NO5 and molecular weight 331.14 g/mol. IUPAC: (1S,13R,16S,18S)-18-methoxy-15-methyl-5,7,12-trioxa-15-azapentacyclo[11.7.0.01,16.02,10.04,8]icosa-2,4(8),9,19-tetraen-13-ol.
Chemical Property Profile of 多花水仙碱
Property Insights of 多花水仙碱
The XLogP value of 1.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 多花水仙碱. The TPSA of 60.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 多花水仙碱. Following Lipinski's Rule of Five, 多花水仙碱 has 1 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 多花水仙碱?
The CAS number of 多花水仙碱 is 507-79-9.
What is the molecular formula of 多花水仙碱?
The molecular formula of 多花水仙碱 is C18H21NO5.
What is the molecular weight of 多花水仙碱?
The molecular weight of 多花水仙碱 is 331.14 g/mol.
Where can I buy 多花水仙碱?
You can request a quote for 多花水仙碱 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 多花水仙碱?
Yes, KEHONG BIO provides custom synthesis services for 多花水仙碱 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.