Anhydrocotarnine-acetone
TL;DR: Anhydrocotarnine-acetone (CAS 51254-35-4) is a chemical compound with molecular formula C15H19NO4 and molecular weight 277.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-methoxy-6-methyl-7,8-dihydro-5H-[1,3]dioxolo[4,5-g]isoquinolin-5-yl)propan-2-one
Also Known As: anhydrocotarnine-acetone, 1-(4-methoxy-6-methyl-5,6,7,8-tetrahydro[1,3]dioxolo[4,5-g]isoquinolin-5-yl)propan-2-one, 1-(4-Methoxy-6-methyl-5,6,7,8-tetrahydro-[1,3]dioxolo[4,5-g]isoquinolin-5-yl)propan-2-one, 1-(4-methoxy-6-methyl-7,8-dihydro-5H-[1,3]dioxolo[4,5-g]isoquinolin-5-yl)propan-2-one, 1-(4-METHOXY-6-METHYL-5,6,7,8-TETRAHYDRO-[1,3]DIOXOLO[4,5-G]ISOQUINOLIN-5-YL)-PROPAN-2-ONE
| Molecular Formula | C15H19NO4 |
|---|---|
| Molecular Weight | 277.13 g/mol |
| LogP | 1.932 |
| Topological Polar Surface Area | 48.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 277.1314 |
| Heavy Atoms | 20 |
| Complexity | 555.29474 |
Chemical Identifiers
| CAS Number | 51254-35-4 |
|---|---|
| SMILES | CC(=O)CC1C2=C(C3=C(C=C2CCN1C)OCO3)OC |
Product Overview
Anhydrocotarnine-acetone (CAS 51254-35-4), with molecular formula C15H19NO4 and molecular weight 277.13 g/mol. IUPAC: 1-(4-methoxy-6-methyl-7,8-dihydro-5H-[1,3]dioxolo[4,5-g]isoquinolin-5-yl)propan-2-one.
Chemical Property Profile of Anhydrocotarnine-acetone
Property Insights of Anhydrocotarnine-acetone
The XLogP value of 1.932 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Anhydrocotarnine-acetone. With a topological polar surface area (TPSA) of 48.0 Ų, Anhydrocotarnine-acetone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Anhydrocotarnine-acetone has 0 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 Anhydrocotarnine-acetone?
The CAS number of Anhydrocotarnine-acetone is 51254-35-4.
What is the molecular formula of Anhydrocotarnine-acetone?
The molecular formula of Anhydrocotarnine-acetone is C15H19NO4.
What is the molecular weight of Anhydrocotarnine-acetone?
The molecular weight of Anhydrocotarnine-acetone is 277.13 g/mol.
Where can I buy Anhydrocotarnine-acetone?
You can request a quote for Anhydrocotarnine-acetone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Anhydrocotarnine-acetone?
Yes, KEHONG BIO provides custom synthesis services for Anhydrocotarnine-acetone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.