12-Hydroxydihydrochelirubine
TL;DR: 12-Hydroxydihydrochelirubine (CAS 131984-77-5) is a chemical compound with molecular formula C21H17NO6 and molecular weight 379.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
15-methoxy-24-methyl-5,7,18,20-tetraoxa-24-azahexacyclo[11.11.0.02,10.04,8.014,22.017,21]tetracosa-1(13),2,4(8),9,11,14,16,21-octaen-11-ol
Also Known As: 12-Hydroxydihydrochelirubine, 12-Hydroxychelirubine, 15-methoxy-24-methyl-5,7,18,20-tetraoxa-24-azahexacyclo[11.11.0.02,10.04,8.014,22.017,21]tetracosa-1(13),2,4(8),9,11,14,16,21-octaen-11-ol, 5-methoxy-13-methyl-13,14-dihydro-2H,10H-[1,3]dioxolo[4,5-i][1,3]dioxolo[4',5':4,5]benzo[1,2-c]phenanthridin-7-ol, [1,3]Benzodioxolo[5,6-c]-1,3-dioxolo[4,5-i]phenanthridin-7-ol, 13,14-dihydro-5-methoxy-13-methyl-
| Molecular Formula | C21H17NO6 |
|---|---|
| Molecular Weight | 379.11 g/mol |
| LogP | 3.7 |
| Topological Polar Surface Area | 69.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 1 |
| Exact Mass | 379.1056 |
| Heavy Atoms | 28 |
| Complexity | 605.0 |
Chemical Identifiers
| CAS Number | 131984-77-5 |
|---|---|
| SMILES | CN1CC2=C3C(=CC(=C2C4=C1C5=CC6=C(C=C5C(=C4)O)OCO6)OC)OCO3 |
| InChIKey | LEHAJESKGINQOW-UHFFFAOYSA-N |
Product Overview
12-Hydroxydihydrochelirubine (CAS 131984-77-5), with molecular formula C21H17NO6 and molecular weight 379.11 g/mol. IUPAC: 15-methoxy-24-methyl-5,7,18,20-tetraoxa-24-azahexacyclo[11.11.0.02,10.04,8.014,22.017,21]tetracosa-1(13),2,4(8),9,11,14,16,21-octaen-11-ol.
Chemical Property Profile of 12-Hydroxydihydrochelirubine
Property Insights of 12-Hydroxydihydrochelirubine
The XLogP value of 3.7 indicates that 12-Hydroxydihydrochelirubine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 69.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 12-Hydroxydihydrochelirubine. Following Lipinski's Rule of Five, 12-Hydroxydihydrochelirubine has 1 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 12-Hydroxydihydrochelirubine?
The CAS number of 12-Hydroxydihydrochelirubine is 131984-77-5.
What is the molecular formula of 12-Hydroxydihydrochelirubine?
The molecular formula of 12-Hydroxydihydrochelirubine is C21H17NO6.
What is the molecular weight of 12-Hydroxydihydrochelirubine?
The molecular weight of 12-Hydroxydihydrochelirubine is 379.11 g/mol.
Where can I buy 12-Hydroxydihydrochelirubine?
You can request a quote for 12-Hydroxydihydrochelirubine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 12-Hydroxydihydrochelirubine?
Yes, KEHONG BIO provides custom synthesis services for 12-Hydroxydihydrochelirubine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.