5-24-04-00046 (Beilstein Handbook Reference)
TL;DR: 5-24-04-00046 (Beilstein Handbook Reference) (CAS 67799-29-5) is a chemical compound with molecular formula C16H16N2O3 and molecular weight 284.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-(3-oxo-1,4-diazatetracyclo[7.5.1.05,15.010,14]pentadeca-5,7,9(15),10(14)-tetraen-4-yl)acetate
Also Known As: 5-24-04-00046 (Beilstein Handbook Reference), 3H,7H-Cyclopenta(4,5)pyrrolo(1,2,3-de)quinoxaline-3-acetic acid, 2,3,8,9-tetrahydro-2-oxo-, methyl ester, Methyl (2-oxo-1,2,8,9-tetrahydro-3H,7H-cyclopenta[4,5]pyrrolo[1,2,3-de]quinoxalin-3-yl)acetate, BRN 0840878
| Molecular Formula | C16H16N2O3 |
|---|---|
| Molecular Weight | 284.12 g/mol |
| LogP | 1.6496 |
| Topological Polar Surface Area | 51.54 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 284.1161 |
| Heavy Atoms | 21 |
| Complexity | 775.41034 |
Chemical Identifiers
| CAS Number | 67799-29-5 |
|---|---|
| SMILES | COC(=O)CN1C(=O)CN2C3=C(CCC3)C4=C2C1=CC=C4 |
Product Overview
5-24-04-00046 (Beilstein Handbook Reference) (CAS 67799-29-5), with molecular formula C16H16N2O3 and molecular weight 284.12 g/mol. IUPAC: methyl 2-(3-oxo-1,4-diazatetracyclo[7.5.1.05,15.010,14]pentadeca-5,7,9(15),10(14)-tetraen-4-yl)acetate.
Chemical Property Profile of 5-24-04-00046 (Beilstein Handbook Reference)
Property Insights of 5-24-04-00046 (Beilstein Handbook Reference)
The XLogP value of 1.6496 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-24-04-00046 (Beilstein Handbook Reference). With a topological polar surface area (TPSA) of 51.54 Ų, 5-24-04-00046 (Beilstein Handbook Reference) exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-24-04-00046 (Beilstein Handbook Reference) has 0 hydrogen bond donor(s) and 3 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 5-24-04-00046 (Beilstein Handbook Reference)?
The CAS number of 5-24-04-00046 (Beilstein Handbook Reference) is 67799-29-5.
What is the molecular formula of 5-24-04-00046 (Beilstein Handbook Reference)?
The molecular formula of 5-24-04-00046 (Beilstein Handbook Reference) is C16H16N2O3.
What is the molecular weight of 5-24-04-00046 (Beilstein Handbook Reference)?
The molecular weight of 5-24-04-00046 (Beilstein Handbook Reference) is 284.12 g/mol.
Where can I buy 5-24-04-00046 (Beilstein Handbook Reference)?
You can request a quote for 5-24-04-00046 (Beilstein Handbook Reference) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-24-04-00046 (Beilstein Handbook Reference)?
Yes, KEHONG BIO provides custom synthesis services for 5-24-04-00046 (Beilstein Handbook Reference) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.