ChemDiv1_027708
TL;DR: ChemDiv1_027708 (CAS 309273-74-3) is a chemical compound with molecular formula C29H23NO5 and molecular weight 465.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 3-(1-acetyl-16,18-dioxo-17-azapentacyclo[6.6.5.02,7.09,14.015,19]nonadeca-2,4,6,9,11,13-hexaen-17-yl)benzoate
Also Known As: ChemDiv1_027708, A2080/0087459, ethyl 3-(1-acetyl-16,18-dioxo-17-azapentacyclo[6.6.5.0~2,7~.0~9,14~.0~15,19~]nonadeca-2,4,6,9,11,13-hexaen-17-yl)benzoate, ethyl 3-(1-acetyl-16,18-dioxo-17-azapentacyclo[6.6.5.0~2,7~.0~9,14~.0~15,19~]nonadeca-2,4,6,9,11,13-hexaen-17-yl)benzoate (non-preferred name), ethyl 3-(1-acetyl-16,18-dioxo-17-azapentacyclo[6.6.5.02,7.09,14.015,19]nonadeca-2,4,6,9,11,13-hexaen-17-yl)benzoate
| Molecular Formula | C29H23NO5 |
|---|---|
| Molecular Weight | 465.16 g/mol |
| LogP | 4.0031 |
| Topological Polar Surface Area | 80.75 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 465.15762 |
| Heavy Atoms | 35 |
| Complexity | 1392.7445 |
Chemical Identifiers
| CAS Number | 309273-74-3 |
|---|---|
| SMILES | CCOC(=O)C1=CC(=CC=C1)N2C(=O)C3C4C5=CC=CC=C5C(C3C2=O)(C6=CC=CC=C46)C(=O)C |
Product Overview
ChemDiv1_027708 (CAS 309273-74-3), with molecular formula C29H23NO5 and molecular weight 465.16 g/mol. IUPAC: ethyl 3-(1-acetyl-16,18-dioxo-17-azapentacyclo[6.6.5.02,7.09,14.015,19]nonadeca-2,4,6,9,11,13-hexaen-17-yl)benzoate.
Chemical Property Profile of ChemDiv1_027708
Property Insights of ChemDiv1_027708
The XLogP value of 4.0031 indicates that ChemDiv1_027708 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 80.75 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv1_027708. Following Lipinski's Rule of Five, ChemDiv1_027708 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 ChemDiv1_027708?
The CAS number of ChemDiv1_027708 is 309273-74-3.
What is the molecular formula of ChemDiv1_027708?
The molecular formula of ChemDiv1_027708 is C29H23NO5.
What is the molecular weight of ChemDiv1_027708?
The molecular weight of ChemDiv1_027708 is 465.16 g/mol.
Where can I buy ChemDiv1_027708?
You can request a quote for ChemDiv1_027708 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_027708?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_027708 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.