ChemDiv3_005581
TL;DR: ChemDiv3_005581 (CAS 713097-24-6) is a chemical compound with molecular formula C26H23ClN4O4 and molecular weight 490.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[4-(4-chlorophenyl)-1-oxophthalazin-2-yl]-N-[4-[2-(methylamino)-2-oxoethoxy]phenyl]propanamide
Also Known As: ChemDiv3_005581, IDI1_023491, BRD-K35708766-001-01-4, 3-[4-(4-chlorophenyl)-1-oxophthalazin-2-yl]-N-[4-[2-(methylamino)-2-oxoethoxy]phenyl]propanamide, 3-(4-(4-chlorophenyl)-1-oxophthalazin-2(1H)-yl)-N-(4-(2-(methylamino)-2-oxoethoxy)phenyl)propanamide
| Molecular Formula | C26H23ClN4O4 |
|---|---|
| Molecular Weight | 490.14 g/mol |
| LogP | 3.8705 |
| Topological Polar Surface Area | 102.32 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 8 |
| Exact Mass | 490.14078 |
| Heavy Atoms | 35 |
| Complexity | 1416.4938 |
Chemical Identifiers
| CAS Number | 713097-24-6 |
|---|---|
| SMILES | CNC(=O)COC1=CC=C(C=C1)NC(=O)CCN2C(=O)C3=CC=CC=C3C(=N2)C4=CC=C(C=C4)Cl |
Product Overview
ChemDiv3_005581 (CAS 713097-24-6), with molecular formula C26H23ClN4O4 and molecular weight 490.14 g/mol. IUPAC: 3-[4-(4-chlorophenyl)-1-oxophthalazin-2-yl]-N-[4-[2-(methylamino)-2-oxoethoxy]phenyl]propanamide.
Chemical Property Profile of ChemDiv3_005581
Property Insights of ChemDiv3_005581
The XLogP value of 3.8705 indicates that ChemDiv3_005581 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 102.32 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv3_005581. Following Lipinski's Rule of Five, ChemDiv3_005581 has 2 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 ChemDiv3_005581?
The CAS number of ChemDiv3_005581 is 713097-24-6.
What is the molecular formula of ChemDiv3_005581?
The molecular formula of ChemDiv3_005581 is C26H23ClN4O4.
What is the molecular weight of ChemDiv3_005581?
The molecular weight of ChemDiv3_005581 is 490.14 g/mol.
Where can I buy ChemDiv3_005581?
You can request a quote for ChemDiv3_005581 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv3_005581?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv3_005581 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.