CTK5E4960
TL;DR: CTK5E4960 (CAS 77801-35-5) is a chemical compound with molecular formula C26H29N3O9 and molecular weight 527.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(2-benzoyl-4-nitrophenyl)-2-morpholin-4-yl-N-propylacetamide;but-2-enedioic acid
Also Known As: N-Propyl-2'-benzoyl-4'-nitro-2-morpholinoacetanilide maleate, Maleate acide de N-propyl benzoyl-2' nitro-4' morpholino-2 acetanilide, N-(2-BENZOYL-4-NITROPHENYL)-2-MORPHOLINO-N-PROPYLACETAMIDE MALEATE, 4-Morpholineacetamide, N-(2-benzoyl-4-nitrophenyl)-N-propyl-, (Z)-2-butenedioate (1:1), Maleate acide de N-propyl benzoyl-2' nitro-4' morpholino-2 acetanilide [French]
| Molecular Formula | C26H29N3O9 |
|---|---|
| Molecular Weight | 527.19 g/mol |
| LogP | 2.6128 |
| Topological Polar Surface Area | 167.59 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 10 |
| Exact Mass | 527.19037 |
| Heavy Atoms | 38 |
| Complexity | 1159.7413 |
Chemical Identifiers
| CAS Number | 77801-35-5 |
|---|---|
| SMILES | CCCN(C1=C(C=C(C=C1)[N+](=O)[O-])C(=O)C2=CC=CC=C2)C(=O)CN3CCOCC3.C(=CC(=O)O)C(=O)O |
Product Overview
CTK5E4960 (CAS 77801-35-5), with molecular formula C26H29N3O9 and molecular weight 527.19 g/mol. IUPAC: N-(2-benzoyl-4-nitrophenyl)-2-morpholin-4-yl-N-propylacetamide;but-2-enedioic acid.
Chemical Property Profile of CTK5E4960
Property Insights of CTK5E4960
The XLogP value of 2.6128 suggests moderate lipophilicity, balancing water solubility and membrane permeability for CTK5E4960. The TPSA of 167.59 Ų indicates high polarity, suggesting CTK5E4960 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, CTK5E4960 has 2 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of CTK5E4960?
The CAS number of CTK5E4960 is 77801-35-5.
What is the molecular formula of CTK5E4960?
The molecular formula of CTK5E4960 is C26H29N3O9.
What is the molecular weight of CTK5E4960?
The molecular weight of CTK5E4960 is 527.19 g/mol.
Where can I buy CTK5E4960?
You can request a quote for CTK5E4960 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for CTK5E4960?
Yes, KEHONG BIO provides custom synthesis services for CTK5E4960 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.