2-Methylolivacinium acetate
TL;DR: 2-Methylolivacinium acetate (CAS 81531-65-9) is a chemical compound with molecular formula C20H20N2O2 and molecular weight 320.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,2,5-trimethyl-6H-pyrido[4,3-b]carbazol-2-ium acetate
Also Known As: 2-Methylolivacinium acetate, Olivacinium acetate-NB methyl RB 544, 6H-Pyrido[4, 1,2,5-trimethyl-, acetate, 1,2,5-trimethyl-6H-pyrido[4,3-b]carbazol-2-ium acetate, 1,2,5-trimethyl-6H-pyrido[4,3-b]carbazol-2-ium,acetate
| Molecular Formula | C20H20N2O2 |
|---|---|
| Molecular Weight | 320.15 g/mol |
| LogP | 2.67184 |
| Topological Polar Surface Area | 59.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 320.15247 |
| Heavy Atoms | 24 |
| Complexity | 1073.521 |
Chemical Identifiers
| CAS Number | 81531-65-9 |
|---|---|
| SMILES | CC1=C2C=C[N+](=C(C2=CC3=C1NC4=CC=CC=C43)C)C.CC(=O)[O-] |
Product Overview
2-Methylolivacinium acetate (CAS 81531-65-9), with molecular formula C20H20N2O2 and molecular weight 320.15 g/mol. IUPAC: 1,2,5-trimethyl-6H-pyrido[4,3-b]carbazol-2-ium acetate.
Chemical Property Profile of 2-Methylolivacinium acetate
Property Insights of 2-Methylolivacinium acetate
The XLogP value of 2.67184 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Methylolivacinium acetate. With a topological polar surface area (TPSA) of 59.8 Ų, 2-Methylolivacinium acetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Methylolivacinium acetate has 1 hydrogen bond donor(s) and 2 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 2-Methylolivacinium acetate?
The CAS number of 2-Methylolivacinium acetate is 81531-65-9.
What is the molecular formula of 2-Methylolivacinium acetate?
The molecular formula of 2-Methylolivacinium acetate is C20H20N2O2.
What is the molecular weight of 2-Methylolivacinium acetate?
The molecular weight of 2-Methylolivacinium acetate is 320.15 g/mol.
Where can I buy 2-Methylolivacinium acetate?
You can request a quote for 2-Methylolivacinium acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Methylolivacinium acetate?
Yes, KEHONG BIO provides custom synthesis services for 2-Methylolivacinium acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.