Amurine
TL;DR: Amurine (CAS 4984-99-0) is a chemical compound with molecular formula C19H19NO4 and molecular weight 325.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(1R,12S)-16-methoxy-20-methyl-5,7-dioxa-20-azapentacyclo[10.5.3.01,13.02,10.04,8]icosa-2,4(8),9,13,16-pentaen-15-one
Also Known As: Amurine, (5S,11bS)-2-Methoxy-14-methyl-5,6-dihydro-3H,9H-5,11b-(epiminoethano)phenanthro[2,3-d][1,3]dioxol-3-one
| Molecular Formula | C19H19NO4 |
|---|---|
| Molecular Weight | 325.13 g/mol |
| LogP | 2.1 |
| Topological Polar Surface Area | 48.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 1 |
| Exact Mass | 325.1314 |
| Heavy Atoms | 24 |
| Complexity | 641.0 |
Chemical Identifiers
| CAS Number | 4984-99-0 |
|---|---|
| SMILES | CN1CC[C@]23C=C(C(=O)C=C2[C@@H]1CC4=CC5=C(C=C34)OCO5)OC |
| InChIKey | HTAGIZQYGRLQQX-IFXJQAMLSA-N |
Product Overview
Amurine (CAS 4984-99-0), with molecular formula C19H19NO4 and molecular weight 325.13 g/mol. IUPAC: (1R,12S)-16-methoxy-20-methyl-5,7-dioxa-20-azapentacyclo[10.5.3.01,13.02,10.04,8]icosa-2,4(8),9,13,16-pentaen-15-one.
Chemical Property Profile of Amurine
Property Insights of Amurine
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Amurine. With a topological polar surface area (TPSA) of 48.0 Ų, Amurine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Amurine 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 Amurine?
The CAS number of Amurine is 4984-99-0.
What is the molecular formula of Amurine?
The molecular formula of Amurine is C19H19NO4.
What is the molecular weight of Amurine?
The molecular weight of Amurine is 325.13 g/mol.
Where can I buy Amurine?
You can request a quote for Amurine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Amurine?
Yes, KEHONG BIO provides custom synthesis services for Amurine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.