ChemDiv2_001484
TL;DR: ChemDiv2_001484 (CAS 577997-05-8) is a chemical compound with molecular formula C21H24N4O4S and molecular weight 428.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-methyl-N-(2-morpholin-4-ylethyl)-5-(4-oxo-3H-phthalazin-1-yl)benzenesulfonamide
Also Known As: ChemDiv2_001484, BAS 06635491, 2-methyl-N-(2-morpholin-4-ylethyl)-5-(4-oxo-3H-phthalazin-1-yl)benzenesulfonamide, 2-methyl-N-(2-morpholinoethyl)-5-(4-oxo-3,4-dihydrophthalazin-1-yl)benzenesulfonamide, 2-methyl-N-[2-(morpholin-4-yl)ethyl]-5-(4-oxo-3,4-dihydrophthalazin-1-yl)benzenesulfonamide
| Molecular Formula | C21H24N4O4S |
|---|---|
| Molecular Weight | 428.15 g/mol |
| LogP | 1.7 |
| Topological Polar Surface Area | 108.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 428.15182 |
| Heavy Atoms | 30 |
| Complexity | 745.0 |
Chemical Identifiers
| CAS Number | 577997-05-8 |
|---|---|
| SMILES | CC1=C(C=C(C=C1)C2=NNC(=O)C3=CC=CC=C32)S(=O)(=O)NCCN4CCOCC4 |
| InChIKey | WBPNGNANACMFPE-UHFFFAOYSA-N |
Product Overview
ChemDiv2_001484 (CAS 577997-05-8), with molecular formula C21H24N4O4S and molecular weight 428.15 g/mol. IUPAC: 2-methyl-N-(2-morpholin-4-ylethyl)-5-(4-oxo-3H-phthalazin-1-yl)benzenesulfonamide.
Chemical Property Profile of ChemDiv2_001484
Property Insights of ChemDiv2_001484
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for ChemDiv2_001484. The TPSA of 108.0 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv2_001484. Following Lipinski's Rule of Five, ChemDiv2_001484 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 ChemDiv2_001484?
The CAS number of ChemDiv2_001484 is 577997-05-8.
What is the molecular formula of ChemDiv2_001484?
The molecular formula of ChemDiv2_001484 is C21H24N4O4S.
What is the molecular weight of ChemDiv2_001484?
The molecular weight of ChemDiv2_001484 is 428.15 g/mol.
Where can I buy ChemDiv2_001484?
You can request a quote for ChemDiv2_001484 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv2_001484?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv2_001484 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.