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2-[4-(4-Iodo-phenyl)-thiazol-2-yl]-5-methyl-2,4-dihydro-pyrazol-3-one
TL;DR: 2-[4-(4-Iodo-phenyl)-thiazol-2-yl]-5-methyl-2,4-dihydro-pyrazol-3-one (CAS 331739-24-3) is a chemical compound with molecular formula C13H10IN3OS and molecular weight 382.96 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[4-(4-iodophenyl)-1,3-thiazol-2-yl]-5-methyl-4H-pyrazol-3-one
Also Known As: BAS 00523540, 2-[4-(4-iodophenyl)-1,3-thiazol-2-yl]-5-methyl-4H-pyrazol-3-one, 2-[4-(4-Iodo-phenyl)-thiazol-2-yl]-5-methyl-2,4-dihydro-pyrazol-3-one, 2-[4-(4-Iodophenyl)-1,3-thiazol-2-yl]-5-methyl-2,4-dihydro-3H-pyrazol-3-one, 2-[4-(4-Iodophenyl)-1,3-thiazol-2-yl]-5-methyl-2,4-dihydro-3H-pyrazol-3-one #
| Molecular Formula | C13H10IN3OS |
|---|---|
| Molecular Weight | 382.96 g/mol |
| LogP | 2.9 |
| Topological Polar Surface Area | 73.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 382.95892 |
| Heavy Atoms | 19 |
| Complexity | 395.0 |
Chemical Identifiers
| CAS Number | 331739-24-3 |
|---|---|
| SMILES | CC1=NN(C(=O)C1)C2=NC(=CS2)C3=CC=C(C=C3)I |
| InChIKey | DOWOISHPSMFFSO-UHFFFAOYSA-N |
Product Overview
2-[4-(4-Iodo-phenyl)-thiazol-2-yl]-5-methyl-2,4-dihydro-pyrazol-3-one (CAS 331739-24-3), with molecular formula C13H10IN3OS and molecular weight 382.96 g/mol. IUPAC: 2-[4-(4-iodophenyl)-1,3-thiazol-2-yl]-5-methyl-4H-pyrazol-3-one.
Chemical Property Profile of 2-[4-(4-Iodo-phenyl)-thiazol-2-yl]-5-methyl-2,4-dihydro-pyrazol-3-one
Property Insights of 2-[4-(4-Iodo-phenyl)-thiazol-2-yl]-5-methyl-2,4-dihydro-pyrazol-3-one
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-[4-(4-Iodo-phenyl)-thiazol-2-yl]-5-methyl-2,4-dihydro-pyrazol-3-one. The TPSA of 73.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-[4-(4-Iodo-phenyl)-thiazol-2-yl]-5-methyl-2,4-dihydro-pyrazol-3-one. Following Lipinski's Rule of Five, 2-[4-(4-Iodo-phenyl)-thiazol-2-yl]-5-methyl-2,4-dihydro-pyrazol-3-one has 0 hydrogen bond donor(s) and 4 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 2-[4-(4-Iodo-phenyl)-thiazol-2-yl]-5-methyl-2,4-dihydro-pyrazol-3-one?
The CAS number of 2-[4-(4-Iodo-phenyl)-thiazol-2-yl]-5-methyl-2,4-dihydro-pyrazol-3-one is 331739-24-3.
What is the molecular formula of 2-[4-(4-Iodo-phenyl)-thiazol-2-yl]-5-methyl-2,4-dihydro-pyrazol-3-one?
The molecular formula of 2-[4-(4-Iodo-phenyl)-thiazol-2-yl]-5-methyl-2,4-dihydro-pyrazol-3-one is C13H10IN3OS.
What is the molecular weight of 2-[4-(4-Iodo-phenyl)-thiazol-2-yl]-5-methyl-2,4-dihydro-pyrazol-3-one?
The molecular weight of 2-[4-(4-Iodo-phenyl)-thiazol-2-yl]-5-methyl-2,4-dihydro-pyrazol-3-one is 382.96 g/mol.
Where can I buy 2-[4-(4-Iodo-phenyl)-thiazol-2-yl]-5-methyl-2,4-dihydro-pyrazol-3-one?
You can request a quote for 2-[4-(4-Iodo-phenyl)-thiazol-2-yl]-5-methyl-2,4-dihydro-pyrazol-3-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[4-(4-Iodo-phenyl)-thiazol-2-yl]-5-methyl-2,4-dihydro-pyrazol-3-one?
Yes, KEHONG BIO provides custom synthesis services for 2-[4-(4-Iodo-phenyl)-thiazol-2-yl]-5-methyl-2,4-dihydro-pyrazol-3-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.