BAS 04375854
TL;DR: BAS 04375854 (CAS 442648-56-8) is a chemical compound with molecular formula C19H21N3O4S and molecular weight 387.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(1-hydroxy-2-methylpropan-2-yl)-2-methyl-5-(4-oxo-3H-phthalazin-1-yl)benzenesulfonamide
Also Known As: BAS 04375854, N-(1-hydroxy-2-methylpropan-2-yl)-2-methyl-5-(4-oxo-3H-phthalazin-1-yl)benzenesulfonamide, N-(1-hydroxy-2-methylpropan-2-yl)-5-(4-hydroxyphthalazin-1-yl)-2-methylbenzenesulfonamide, N-(1-hydroxy-2-methylpropan-2-yl)-2-methyl-5-(4-oxo-3,4-dihydrophthalazin-1-yl)benzenesulfonamide
| Molecular Formula | C19H21N3O4S |
|---|---|
| Molecular Weight | 387.13 g/mol |
| LogP | 1.94772 |
| Topological Polar Surface Area | 112.15 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 387.12527 |
| Heavy Atoms | 27 |
| Complexity | 1167.0334 |
Chemical Identifiers
| CAS Number | 442648-56-8 |
|---|---|
| SMILES | CC1=C(C=C(C=C1)C2=NNC(=O)C3=CC=CC=C32)S(=O)(=O)NC(C)(C)CO |
Product Overview
BAS 04375854 (CAS 442648-56-8), with molecular formula C19H21N3O4S and molecular weight 387.13 g/mol. IUPAC: N-(1-hydroxy-2-methylpropan-2-yl)-2-methyl-5-(4-oxo-3H-phthalazin-1-yl)benzenesulfonamide.
Chemical Property Profile of BAS 04375854
Property Insights of BAS 04375854
The XLogP value of 1.94772 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 04375854. The TPSA of 112.15 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 04375854. Following Lipinski's Rule of Five, BAS 04375854 has 3 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 BAS 04375854?
The CAS number of BAS 04375854 is 442648-56-8.
What is the molecular formula of BAS 04375854?
The molecular formula of BAS 04375854 is C19H21N3O4S.
What is the molecular weight of BAS 04375854?
The molecular weight of BAS 04375854 is 387.13 g/mol.
Where can I buy BAS 04375854?
You can request a quote for BAS 04375854 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 04375854?
Yes, KEHONG BIO provides custom synthesis services for BAS 04375854 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.