Cularidine
TL;DR: Cularidine (CAS 5140-50-1) is a chemical compound with molecular formula C19H21NO4 and molecular weight 327.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(10S)-5,6-dimethoxy-11-methyl-2-oxa-11-azatetracyclo[8.7.1.03,8.014,18]octadeca-1(17),3,5,7,14(18),15-hexaen-17-ol
Also Known As: Cularidine, (+)-Cularidine, (10S)-5,6-dimethoxy-11-methyl-2-oxa-11-azatetracyclo[8.7.1.03,8.014,18]octadeca-1(17),3,5,7,14(18),15-hexaen-17-ol, (5aS,9aS,9bR)-6,6,9a-trimethyl-5,5a,7,8,9,9b-hexahydro-3H-benzo(g)isobenzofuran-1-one, (10S)-5,6-dimethoxy-11-methyl-2-oxa-11-azatetracyclo(8.7.1.03,8.014,18)octadeca-1(17),3,5,7,14(18),15-hexaen-17-ol
| Molecular Formula | C19H21NO4 |
|---|---|
| Molecular Weight | 327.15 g/mol |
| LogP | 3.0 |
| Topological Polar Surface Area | 51.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 327.14706 |
| Heavy Atoms | 24 |
| Complexity | 447.0 |
Chemical Identifiers
| CAS Number | 5140-50-1 |
|---|---|
| SMILES | CN1CCC2=C3[C@@H]1CC4=CC(=C(C=C4OC3=C(C=C2)O)OC)OC |
| InChIKey | ITGZZZYNPULRNZ-ZDUSSCGKSA-N |
Product Overview
Cularidine (CAS 5140-50-1), with molecular formula C19H21NO4 and molecular weight 327.15 g/mol. IUPAC: (10S)-5,6-dimethoxy-11-methyl-2-oxa-11-azatetracyclo[8.7.1.03,8.014,18]octadeca-1(17),3,5,7,14(18),15-hexaen-17-ol.
Chemical Property Profile of Cularidine
Property Insights of Cularidine
The XLogP value of 3.0 indicates that Cularidine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 51.2 Ų, Cularidine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Cularidine 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 Cularidine?
The CAS number of Cularidine is 5140-50-1.
What is the molecular formula of Cularidine?
The molecular formula of Cularidine is C19H21NO4.
What is the molecular weight of Cularidine?
The molecular weight of Cularidine is 327.15 g/mol.
Where can I buy Cularidine?
You can request a quote for Cularidine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Cularidine?
Yes, KEHONG BIO provides custom synthesis services for Cularidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.