BAS 04936801
TL;DR: BAS 04936801 (CAS 510760-07-3) is a chemical compound with molecular formula C25H25N5O4S and molecular weight 491.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[4-[[4-[3-(2-hydroxyethylsulfamoyl)-4-methylphenyl]phthalazin-1-yl]amino]phenyl]acetamide
Also Known As: BAS 04936801, 2-[4-[[4-[3-(2-hydroxyethylsulfamoyl)-4-methylphenyl]phthalazin-1-yl]amino]phenyl]acetamide, 2-{4-[(4-{3-[(2-hydroxyethyl)sulfamoyl]-4-methylphenyl}phthalazin-1-yl)amino]phenyl}acetamide, 2-(4-((4-(3-(N-(2-hydroxyethyl)sulfamoyl)-4-methylphenyl)phthalazin-1-yl)amino)phenyl)acetamide, 2-(4-{[(1Z)-4-{3-[(2-hydroxyethyl)sulfamoyl]-4-methylphenyl}phthalazin-1(2H)-ylidene]amino}phenyl)acetamide
| Molecular Formula | C25H25N5O4S |
|---|---|
| Molecular Weight | 491.16 g/mol |
| LogP | 2.64722 |
| Topological Polar Surface Area | 147.3 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 9 |
| Exact Mass | 491.16272 |
| Heavy Atoms | 35 |
| Complexity | 1488.0167 |
Chemical Identifiers
| CAS Number | 510760-07-3 |
|---|---|
| SMILES | CC1=C(C=C(C=C1)C2=NN=C(C3=CC=CC=C32)NC4=CC=C(C=C4)CC(=O)N)S(=O)(=O)NCCO |
Product Overview
BAS 04936801 (CAS 510760-07-3), with molecular formula C25H25N5O4S and molecular weight 491.16 g/mol. IUPAC: 2-[4-[[4-[3-(2-hydroxyethylsulfamoyl)-4-methylphenyl]phthalazin-1-yl]amino]phenyl]acetamide.
Chemical Property Profile of BAS 04936801
Property Insights of BAS 04936801
The XLogP value of 2.64722 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 04936801. The TPSA of 147.3 Ų indicates high polarity, suggesting BAS 04936801 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, BAS 04936801 has 4 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 BAS 04936801?
The CAS number of BAS 04936801 is 510760-07-3.
What is the molecular formula of BAS 04936801?
The molecular formula of BAS 04936801 is C25H25N5O4S.
What is the molecular weight of BAS 04936801?
The molecular weight of BAS 04936801 is 491.16 g/mol.
Where can I buy BAS 04936801?
You can request a quote for BAS 04936801 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 04936801?
Yes, KEHONG BIO provides custom synthesis services for BAS 04936801 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.