ChemDiv3_005135
TL;DR: ChemDiv3_005135 (CAS 685132-03-0) is a chemical compound with molecular formula C28H29N5O4 and molecular weight 499.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-[[4-[4-[2-(diethylamino)-2-oxoethoxy]phenyl]phthalazin-1-yl]amino]-2-methoxybenzamide
Also Known As: ChemDiv3_005135, BAS 05946807, IDI1_023045, 5-((4-(4-(2-(diethylamino)-2-oxoethoxy)phenyl)phthalazin-1-yl)amino)-2-methoxybenzamide, 5-[(4-{4-[2-(diethylamino)-2-oxoethoxy]phenyl}-1-phthalazinyl)amino]-2-methoxybenzamide
| Molecular Formula | C28H29N5O4 |
|---|---|
| Molecular Weight | 499.22 g/mol |
| LogP | 4.3951 |
| Topological Polar Surface Area | 119.67 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 10 |
| Exact Mass | 499.22195 |
| Heavy Atoms | 37 |
| Complexity | 1418.2811 |
Chemical Identifiers
| CAS Number | 685132-03-0 |
|---|---|
| SMILES | CCN(CC)C(=O)COC1=CC=C(C=C1)C2=NN=C(C3=CC=CC=C32)NC4=CC(=C(C=C4)OC)C(=O)N |
Product Overview
ChemDiv3_005135 (CAS 685132-03-0), with molecular formula C28H29N5O4 and molecular weight 499.22 g/mol. IUPAC: 5-[[4-[4-[2-(diethylamino)-2-oxoethoxy]phenyl]phthalazin-1-yl]amino]-2-methoxybenzamide.
Chemical Property Profile of ChemDiv3_005135
Property Insights of ChemDiv3_005135
The XLogP value of 4.3951 indicates that ChemDiv3_005135 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 119.67 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv3_005135. Following Lipinski's Rule of Five, ChemDiv3_005135 has 2 hydrogen bond donor(s) and 7 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_005135?
The CAS number of ChemDiv3_005135 is 685132-03-0.
What is the molecular formula of ChemDiv3_005135?
The molecular formula of ChemDiv3_005135 is C28H29N5O4.
What is the molecular weight of ChemDiv3_005135?
The molecular weight of ChemDiv3_005135 is 499.22 g/mol.
Where can I buy ChemDiv3_005135?
You can request a quote for ChemDiv3_005135 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv3_005135?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv3_005135 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.