BAS 08978753
TL;DR: BAS 08978753 (CAS 710987-29-4) is a chemical compound with molecular formula C18H19N3O6S2 and molecular weight 437.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[4-[3-(1,3-benzodioxol-5-yl)-2-methylsulfonyl-3,4-dihydropyrazol-5-yl]phenyl]methanesulfonamide
Also Known As: BAS 08978753, N-[4-[3-(1,3-benzodioxol-5-yl)-2-methylsulfonyl-3,4-dihydropyrazol-5-yl]phenyl]methanesulfonamide, N-(4-(5-(benzo[d][1,3]dioxol-5-yl)-1-(methylsulfonyl)-4,5-dihydro-1H-pyrazol-3-yl)phenyl)methanesulfonamide, N-{4-[5-(2H-1,3-benzodioxol-5-yl)-1-methanesulfonyl-4,5-dihydro-1H-pyrazol-3-yl]phenyl}methanesulfonamide, N-[4-(5-Benzo[1,3]dioxol-5-yl-1-methanesulfonyl-4,5-dihydro-1H-pyrazol-3-yl)-phenyl]-methanesulfonamide
| Molecular Formula | C18H19N3O6S2 |
|---|---|
| Molecular Weight | 437.07 g/mol |
| LogP | 1.8975 |
| Topological Polar Surface Area | 114.37 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 437.07153 |
| Heavy Atoms | 29 |
| Complexity | 1190.6023 |
Chemical Identifiers
| CAS Number | 710987-29-4 |
|---|---|
| SMILES | CS(=O)(=O)NC1=CC=C(C=C1)C2=NN(C(C2)C3=CC4=C(C=C3)OCO4)S(=O)(=O)C |
Product Overview
BAS 08978753 (CAS 710987-29-4), with molecular formula C18H19N3O6S2 and molecular weight 437.07 g/mol. IUPAC: N-[4-[3-(1,3-benzodioxol-5-yl)-2-methylsulfonyl-3,4-dihydropyrazol-5-yl]phenyl]methanesulfonamide.
Chemical Property Profile of BAS 08978753
Property Insights of BAS 08978753
The XLogP value of 1.8975 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 08978753. The TPSA of 114.37 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 08978753. Following Lipinski's Rule of Five, BAS 08978753 has 1 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 08978753?
The CAS number of BAS 08978753 is 710987-29-4.
What is the molecular formula of BAS 08978753?
The molecular formula of BAS 08978753 is C18H19N3O6S2.
What is the molecular weight of BAS 08978753?
The molecular weight of BAS 08978753 is 437.07 g/mol.
Where can I buy BAS 08978753?
You can request a quote for BAS 08978753 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 08978753?
Yes, KEHONG BIO provides custom synthesis services for BAS 08978753 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.