CBKinase1_005748
TL;DR: CBKinase1_005748 (CAS 701229-53-0) is a chemical compound with molecular formula C25H22N4O4 and molecular weight 442.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[4-[2-(methylamino)-2-oxoethoxy]phenyl]-4-(3-methyl-4-oxophthalazin-1-yl)benzamide
Also Known As: CBKinase1_005748, CBKinase1_018148, BAS 07007940, BRD-K72910427-001-01-1, N-[4-[2-(methylamino)-2-oxoethoxy]phenyl]-4-(3-methyl-4-oxophthalazin-1-yl)benzamide
| Molecular Formula | C25H22N4O4 |
|---|---|
| Molecular Weight | 442.16 g/mol |
| LogP | 2.9776 |
| Topological Polar Surface Area | 102.32 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 442.1641 |
| Heavy Atoms | 33 |
| Complexity | 1376.6989 |
Chemical Identifiers
| CAS Number | 701229-53-0 |
|---|---|
| SMILES | CNC(=O)COC1=CC=C(C=C1)NC(=O)C2=CC=C(C=C2)C3=NN(C(=O)C4=CC=CC=C43)C |
Product Overview
CBKinase1_005748 (CAS 701229-53-0), with molecular formula C25H22N4O4 and molecular weight 442.16 g/mol. IUPAC: N-[4-[2-(methylamino)-2-oxoethoxy]phenyl]-4-(3-methyl-4-oxophthalazin-1-yl)benzamide.
Chemical Property Profile of CBKinase1_005748
Property Insights of CBKinase1_005748
The XLogP value of 2.9776 suggests moderate lipophilicity, balancing water solubility and membrane permeability for CBKinase1_005748. The TPSA of 102.32 Ų falls within the moderate polarity range, balancing permeability and solubility for CBKinase1_005748. Following Lipinski's Rule of Five, CBKinase1_005748 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 CBKinase1_005748?
The CAS number of CBKinase1_005748 is 701229-53-0.
What is the molecular formula of CBKinase1_005748?
The molecular formula of CBKinase1_005748 is C25H22N4O4.
What is the molecular weight of CBKinase1_005748?
The molecular weight of CBKinase1_005748 is 442.16 g/mol.
Where can I buy CBKinase1_005748?
You can request a quote for CBKinase1_005748 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for CBKinase1_005748?
Yes, KEHONG BIO provides custom synthesis services for CBKinase1_005748 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.