TL;DR: J3.246.173E (CAS 1164477-54-6) is a chemical compound with molecular formula C19H12F2N2O3S and molecular weight 386.05368 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(E)-3-(1,3-benzodioxol-5-yl)-N-[4-(2,4-difluorophenyl)-1,3-thiazol-2-yl]prop-2-enamide
Also Known As: J3.246.173E, (E)-3-(1,3-benzodioxol-5-yl)-N-[4-(2,4-difluorophenyl)-1,3-thiazol-2-yl]prop-2-enamide, N-[4-(2,4-Difluorophenyl)-2-thiazolyl]-3-(1,3-benzodioxole-5-yl)acrylamide, 3-(1,3-benzodioxol-5-yl)-N-[4-(2,4-difluorophenyl)-1,3-thiazol-2-yl]acrylamide, 3-(2H-1,3-benzodioxol-5-yl)-N-[4-(2,4-difluorophenyl)-1,3-thiazol-2-yl]prop-2-enamide
| Molecular Formula | C19H12F2N2O3S |
| Molecular Weight | 386.05368 g/mol |
| XLogP | 4.2 |
| Topological Polar Surface Area (TPSA) | 88.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 386.05368 Da |
| Heavy Atoms | 27 |
| Complexity | 567.0 |
| SMILES | C1OC2=C(O1)C=C(C=C2)/C=C/C(=O)NC3=NC(=CS3)C4=C(C=C(C=C4)F)F |
| InChIKey | JIKRTXPPRWWOGY-QHHAFSJGSA-N |
The XLogP value of 4.2 indicates that J3.246.173E is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 88.7 Ų falls within the moderate polarity range, balancing permeability and solubility for J3.246.173E. Following Lipinski's Rule of Five, J3.246.173E has 1 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of J3.246.173E is 1164477-54-6.
The molecular formula of J3.246.173E is C19H12F2N2O3S.
The molecular weight of J3.246.173E is 386.05368 g/mol.
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