Bitlisine
TL;DR: Bitlisine (CAS 105223-81-2) is a chemical compound with molecular formula C20H19NO6 and molecular weight 369.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,20-dihydroxy-19-methoxy-14-methyl-5,7-dioxa-14-azapentacyclo[11.7.1.03,11.04,8.017,21]henicosa-1(21),3(11),4(8),9,17,19-hexaen-12-one
Also Known As: Bitlisine, 1,3-Benzodioxolo(5',4':5,6)cyclohept(1,2,3-ij)isoquinolin-6(7H)-one, 6a,8,9,13-tetrahydro-12,13-dihydroxy-11-methoxy-7-methyl-, 12,13-Dihydroxy-11-methoxy-7-methyl-6a,8,9,13-tetrahydro-2H-[1,3]benzodioxolo[5',4':5,6]cyclohepta[1,2,3-ij]isoquinolin-6(7H)-one
| Molecular Formula | C20H19NO6 |
|---|---|
| Molecular Weight | 369.12 g/mol |
| LogP | 1.8 |
| Topological Polar Surface Area | 88.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 1 |
| Exact Mass | 369.12125 |
| Heavy Atoms | 27 |
| Complexity | 601.0 |
Chemical Identifiers
| CAS Number | 105223-81-2 |
|---|---|
| SMILES | CN1CCC2=CC(=C(C3=C2C1C(=O)C4=C(C3O)C5=C(C=C4)OCO5)O)OC |
| InChIKey | GDKJFMVLMNXVHM-UHFFFAOYSA-N |
Product Overview
Bitlisine (CAS 105223-81-2), with molecular formula C20H19NO6 and molecular weight 369.12 g/mol. IUPAC: 2,20-dihydroxy-19-methoxy-14-methyl-5,7-dioxa-14-azapentacyclo[11.7.1.03,11.04,8.017,21]henicosa-1(21),3(11),4(8),9,17,19-hexaen-12-one.
Chemical Property Profile of Bitlisine
Property Insights of Bitlisine
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Bitlisine. The TPSA of 88.5 Ų falls within the moderate polarity range, balancing permeability and solubility for Bitlisine. Following Lipinski's Rule of Five, Bitlisine has 2 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 Bitlisine?
The CAS number of Bitlisine is 105223-81-2.
What is the molecular formula of Bitlisine?
The molecular formula of Bitlisine is C20H19NO6.
What is the molecular weight of Bitlisine?
The molecular weight of Bitlisine is 369.12 g/mol.
Where can I buy Bitlisine?
You can request a quote for Bitlisine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Bitlisine?
Yes, KEHONG BIO provides custom synthesis services for Bitlisine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.