![(E)-3-(5-dimethylamino-2-furyl)-2-[(5-propyl-1H-1,2,4-triazol-3-yl)sulfanyl]prop-2-enoic Acid structure](/static/products/100/1003976-53-1.png)
(E)-3-(5-dimethylamino-2-furyl)-2-[(5-propyl-1H-1,2,4-triazol-3-yl)sulfanyl]prop-2-enoic Acid
TL;DR: (E)-3-(5-dimethylamino-2-furyl)-2-[(5-propyl-1H-1,2,4-triazol-3-yl)sulfanyl]prop-2-enoic Acid (CAS 1003976-53-1) is a chemical compound with molecular formula C14H18N4O3S and molecular weight 322.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-3-[5-(dimethylamino)furan-2-yl]-2-[(5-propyl-1H-1,2,4-triazol-3-yl)sulfanyl]prop-2-enoic acid
Also Known As: (E)-3-(5-dimethylamino-2-furyl)-2-[(5-propyl-1H-1,2,4-triazol-3-yl)sulfanyl]prop-2-enoic Acid, (E)-3-[5-(dimethylamino)furan-2-yl]-2-[(5-propyl-1H-1,2,4-triazol-3-yl)sulfanyl]prop-2-enoic acid, 2-Propenoic acid, 3-[5-(dimethylamino)-2-furanyl]-2-[(3-propyl-1H-1,2,4-triazol-5-yl)thio]-, (2E)-
| Molecular Formula | C14H18N4O3S |
|---|---|
| Molecular Weight | 322.11 g/mol |
| LogP | 2.634 |
| Topological Polar Surface Area | 95.25 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 322.10995 |
| Heavy Atoms | 22 |
| Complexity | 675.19086 |
Chemical Identifiers
| CAS Number | 1003976-53-1 |
|---|---|
| SMILES | CCCC1=NC(=NN1)S/C(=C/C2=CC=C(O2)N(C)C)/C(=O)O |
Product Overview
(E)-3-(5-dimethylamino-2-furyl)-2-[(5-propyl-1H-1,2,4-triazol-3-yl)sulfanyl]prop-2-enoic Acid (CAS 1003976-53-1), with molecular formula C14H18N4O3S and molecular weight 322.11 g/mol. IUPAC: (E)-3-[5-(dimethylamino)furan-2-yl]-2-[(5-propyl-1H-1,2,4-triazol-3-yl)sulfanyl]prop-2-enoic acid.
Chemical Property Profile of (E)-3-(5-dimethylamino-2-furyl)-2-[(5-propyl-1H-1,2,4-triazol-3-yl)sulfanyl]prop-2-enoic Acid
Property Insights of (E)-3-(5-dimethylamino-2-furyl)-2-[(5-propyl-1H-1,2,4-triazol-3-yl)sulfanyl]prop-2-enoic Acid
The XLogP value of 2.634 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (E)-3-(5-dimethylamino-2-furyl)-2-[(5-propyl-1H-1,2,4-triazol-3-yl)sulfanyl]prop-2-enoic Acid. The TPSA of 95.25 Ų falls within the moderate polarity range, balancing permeability and solubility for (E)-3-(5-dimethylamino-2-furyl)-2-[(5-propyl-1H-1,2,4-triazol-3-yl)sulfanyl]prop-2-enoic Acid. Following Lipinski's Rule of Five, (E)-3-(5-dimethylamino-2-furyl)-2-[(5-propyl-1H-1,2,4-triazol-3-yl)sulfanyl]prop-2-enoic Acid has 2 hydrogen bond donor(s) and 6 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 (E)-3-(5-dimethylamino-2-furyl)-2-[(5-propyl-1H-1,2,4-triazol-3-yl)sulfanyl]prop-2-enoic Acid?
The CAS number of (E)-3-(5-dimethylamino-2-furyl)-2-[(5-propyl-1H-1,2,4-triazol-3-yl)sulfanyl]prop-2-enoic Acid is 1003976-53-1.
What is the molecular formula of (E)-3-(5-dimethylamino-2-furyl)-2-[(5-propyl-1H-1,2,4-triazol-3-yl)sulfanyl]prop-2-enoic Acid?
The molecular formula of (E)-3-(5-dimethylamino-2-furyl)-2-[(5-propyl-1H-1,2,4-triazol-3-yl)sulfanyl]prop-2-enoic Acid is C14H18N4O3S.
What is the molecular weight of (E)-3-(5-dimethylamino-2-furyl)-2-[(5-propyl-1H-1,2,4-triazol-3-yl)sulfanyl]prop-2-enoic Acid?
The molecular weight of (E)-3-(5-dimethylamino-2-furyl)-2-[(5-propyl-1H-1,2,4-triazol-3-yl)sulfanyl]prop-2-enoic Acid is 322.11 g/mol.
Where can I buy (E)-3-(5-dimethylamino-2-furyl)-2-[(5-propyl-1H-1,2,4-triazol-3-yl)sulfanyl]prop-2-enoic Acid?
You can request a quote for (E)-3-(5-dimethylamino-2-furyl)-2-[(5-propyl-1H-1,2,4-triazol-3-yl)sulfanyl]prop-2-enoic Acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (E)-3-(5-dimethylamino-2-furyl)-2-[(5-propyl-1H-1,2,4-triazol-3-yl)sulfanyl]prop-2-enoic Acid?
Yes, KEHONG BIO provides custom synthesis services for (E)-3-(5-dimethylamino-2-furyl)-2-[(5-propyl-1H-1,2,4-triazol-3-yl)sulfanyl]prop-2-enoic Acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.