C071-0303
TL;DR: C071-0303 (CAS 685526-67-4) is a chemical compound with molecular formula C23H20F3N3O7S and molecular weight 539.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[4-(1,3-benzodioxol-5-yl)-6-(trifluoromethyl)pyrimidin-2-yl]sulfonyl-N-(2,4-dimethoxyphenyl)propanamide
Also Known As: C071-0303, 3-((4-(Benzo[d][1,3]dioxol-5-yl)-6-(trifluoromethyl)pyrimidin-2-yl)sulfonyl)-N-(2,4-dimethoxyphenyl)propanamide, 3-[4-(1,3-benzodioxol-5-yl)-6-(trifluoromethyl)pyrimidin-2-yl]sulfonyl-N-(2,4-dimethoxyphenyl)propanamide, 3-{[4-(2H-1,3-BENZODIOXOL-5-YL)-6-(TRIFLUOROMETHYL)PYRIMIDIN-2-YL]SULFONYL}-N-(2,4-DIMETHOXYPHENYL)PROPANAMIDE, 3-{[4-(2H-benzo[3,4-d]1,3-dioxolen-5-yl)-6-(trifluoromethyl)pyrimidin-2-yl]sul fonyl}-N-(2,4-dimethoxyphenyl)propanamide
| Molecular Formula | C23H20F3N3O7S |
|---|---|
| Molecular Weight | 539.10 g/mol |
| LogP | 3.7108 |
| Topological Polar Surface Area | 125.94 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 8 |
| Exact Mass | 539.0974 |
| Heavy Atoms | 37 |
| Complexity | 1445.9828 |
Chemical Identifiers
| CAS Number | 685526-67-4 |
|---|---|
| SMILES | COC1=CC(=C(C=C1)NC(=O)CCS(=O)(=O)C2=NC(=CC(=N2)C(F)(F)F)C3=CC4=C(C=C3)OCO4)OC |
Product Overview
C071-0303 (CAS 685526-67-4), with molecular formula C23H20F3N3O7S and molecular weight 539.10 g/mol. IUPAC: 3-[4-(1,3-benzodioxol-5-yl)-6-(trifluoromethyl)pyrimidin-2-yl]sulfonyl-N-(2,4-dimethoxyphenyl)propanamide.
Chemical Property Profile of C071-0303
Property Insights of C071-0303
The XLogP value of 3.7108 indicates that C071-0303 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 125.94 Ų falls within the moderate polarity range, balancing permeability and solubility for C071-0303. Following Lipinski's Rule of Five, C071-0303 has 1 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of C071-0303?
The CAS number of C071-0303 is 685526-67-4.
What is the molecular formula of C071-0303?
The molecular formula of C071-0303 is C23H20F3N3O7S.
What is the molecular weight of C071-0303?
The molecular weight of C071-0303 is 539.10 g/mol.
Where can I buy C071-0303?
You can request a quote for C071-0303 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for C071-0303?
Yes, KEHONG BIO provides custom synthesis services for C071-0303 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.