BAS 04375850
TL;DR: BAS 04375850 (CAS 444077-03-6) is a chemical compound with molecular formula C20H21N3O3S2 and molecular weight 415.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-methyl-N-(oxolan-2-ylmethyl)-5-(4-sulfanylidene-3H-phthalazin-1-yl)benzenesulfonamide
Also Known As: BAS 04375850, 2-methyl-N-(tetrahydrofuran-2-ylmethyl)-5-(4-thioxo-3,4-dihydrophthalazin-1-yl)benzenesulfonamide, 2-methyl-5-(4-sulfanylphthalazin-1-yl)-N-(tetrahydrofuran-2-ylmethyl)benzenesulfonamide, 2-methyl-N-(oxolan-2-ylmethyl)-5-(4-sulfanylidene-3H-phthalazin-1-yl)benzenesulfonamide, 2-methyl-N-((tetrahydrofuran-2-yl)methyl)-5-(4-thioxo-3,4-dihydrophthalazin-1-yl)benzenesulfonamide
| Molecular Formula | C20H21N3O3S2 |
|---|---|
| Molecular Weight | 415.10 g/mol |
| LogP | 3.72511 |
| Topological Polar Surface Area | 84.08 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 415.10245 |
| Heavy Atoms | 28 |
| Complexity | 1182.7654 |
Chemical Identifiers
| CAS Number | 444077-03-6 |
|---|---|
| SMILES | CC1=C(C=C(C=C1)C2=NNC(=S)C3=CC=CC=C32)S(=O)(=O)NCC4CCCO4 |
Product Overview
BAS 04375850 (CAS 444077-03-6), with molecular formula C20H21N3O3S2 and molecular weight 415.10 g/mol. IUPAC: 2-methyl-N-(oxolan-2-ylmethyl)-5-(4-sulfanylidene-3H-phthalazin-1-yl)benzenesulfonamide.
Chemical Property Profile of BAS 04375850
Property Insights of BAS 04375850
The XLogP value of 3.72511 indicates that BAS 04375850 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 84.08 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 04375850. Following Lipinski's Rule of Five, BAS 04375850 has 2 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 04375850?
The CAS number of BAS 04375850 is 444077-03-6.
What is the molecular formula of BAS 04375850?
The molecular formula of BAS 04375850 is C20H21N3O3S2.
What is the molecular weight of BAS 04375850?
The molecular weight of BAS 04375850 is 415.10 g/mol.
Where can I buy BAS 04375850?
You can request a quote for BAS 04375850 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 04375850?
Yes, KEHONG BIO provides custom synthesis services for BAS 04375850 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.