CAS 617697-33-3 - C28H25FN2O7S
TL;DR: CAS 617697-33-3 - C28H25FN2O7S (CAS 617697-33-3) is a chemical compound with molecular formula C28H25FN2O7S and molecular weight 552.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
prop-2-enyl 2-[(3E)-2-(3,4-dimethoxyphenyl)-3-[(3-fluoro-4-methylphenyl)-hydroxymethylidene]-4,5-dioxopyrrolidin-1-yl]-4-methyl-1,3-thiazole-5-carboxylate
Also Known As: Allyl 2-(2-(3,4-dimethoxyphenyl)-3-(3-fluoro-4-methylbenzoyl)-4-hydroxy-5-oxo-2,5-dihydro-1H-pyrrol-1-yl)-4-methylthiazole-5-carboxylate
| Molecular Formula | C28H25FN2O7S |
|---|---|
| Molecular Weight | 552.14 g/mol |
| LogP | 4.88534 |
| Topological Polar Surface Area | 115.26 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 8 |
| Exact Mass | 552.13666 |
| Heavy Atoms | 39 |
| Complexity | 1528.0446 |
Chemical Identifiers
| CAS Number | 617697-33-3 |
|---|---|
| SMILES | CC1=C(C=C(C=C1)/C(=C\2/C(N(C(=O)C2=O)C3=NC(=C(S3)C(=O)OCC=C)C)C4=CC(=C(C=C4)OC)OC)/O)F |
Product Overview
CAS 617697-33-3 - C28H25FN2O7S (CAS 617697-33-3), with molecular formula C28H25FN2O7S and molecular weight 552.14 g/mol. IUPAC: prop-2-enyl 2-[(3E)-2-(3,4-dimethoxyphenyl)-3-[(3-fluoro-4-methylphenyl)-hydroxymethylidene]-4,5-dioxopyrrolidin-1-yl]-4-methyl-1,3-thiazole-5-carboxylate.
Chemical Property Profile of CAS 617697-33-3 - C28H25FN2O7S
Property Insights of CAS 617697-33-3 - C28H25FN2O7S
The XLogP value of 4.88534 indicates that CAS 617697-33-3 - C28H25FN2O7S is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 115.26 Ų falls within the moderate polarity range, balancing permeability and solubility for CAS 617697-33-3 - C28H25FN2O7S. Following Lipinski's Rule of Five, CAS 617697-33-3 - C28H25FN2O7S 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 CAS 617697-33-3 - C28H25FN2O7S?
The CAS number of CAS 617697-33-3 - C28H25FN2O7S is 617697-33-3.
What is the molecular formula of CAS 617697-33-3 - C28H25FN2O7S?
The molecular formula of CAS 617697-33-3 - C28H25FN2O7S is C28H25FN2O7S.
What is the molecular weight of CAS 617697-33-3 - C28H25FN2O7S?
The molecular weight of CAS 617697-33-3 - C28H25FN2O7S is 552.14 g/mol.
Where can I buy CAS 617697-33-3 - C28H25FN2O7S?
You can request a quote for CAS 617697-33-3 - C28H25FN2O7S directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for CAS 617697-33-3 - C28H25FN2O7S?
Yes, KEHONG BIO provides custom synthesis services for CAS 617697-33-3 - C28H25FN2O7S and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.