![dipropan-2-yl 3-methyl-5-[[(E)-3-(3-nitrophenyl)prop-2-enoyl]amino]thiophene-2,4-dicarboxylate structure](/static/products/5503/550316-06-8.webp)
dipropan-2-yl 3-methyl-5-[[(E)-3-(3-nitrophenyl)prop-2-enoyl]amino]thiophene-2,4-dicarboxylate
TL;DR: dipropan-2-yl 3-methyl-5-[[(E)-3-(3-nitrophenyl)prop-2-enoyl]amino]thiophene-2,4-dicarboxylate (CAS 550316-06-8) is a chemical compound with molecular formula C22H24N2O7S and molecular weight 460.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
dipropan-2-yl 3-methyl-5-[[(E)-3-(3-nitrophenyl)prop-2-enoyl]amino]thiophene-2,4-dicarboxylate
Also Known As: dipropan-2-yl 3-methyl-5-[[(E)-3-(3-nitrophenyl)prop-2-enoyl]amino]thiophene-2,4-dicarboxylate, diisopropyl 5-[(3-{3-nitrophenyl}acryloyl)amino]-3-methyl-2,4-thiophenedicarboxylate, dipropan-2-yl 3-methyl-5-{[(2E)-3-(3-nitrophenyl)prop-2-enoyl]amino}thiophene-2,4-dicarboxylate, methylethyl 5-[(2E)-3-(3-nitrophenyl)prop-2-enoylamino]-3-methyl-4-[(methyleth yl)oxycarbonyl]thiophene-2-carboxylate
| Molecular Formula | C22H24N2O7S |
|---|---|
| Molecular Weight | 460.13 g/mol |
| LogP | 4.74702 |
| Topological Polar Surface Area | 124.84 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 8 |
| Exact Mass | 460.13043 |
| Heavy Atoms | 32 |
| Complexity | 1070.2268 |
Chemical Identifiers
| CAS Number | 550316-06-8 |
|---|---|
| SMILES | CC1=C(SC(=C1C(=O)OC(C)C)NC(=O)/C=C/C2=CC(=CC=C2)[N+](=O)[O-])C(=O)OC(C)C |
Product Overview
dipropan-2-yl 3-methyl-5-[[(E)-3-(3-nitrophenyl)prop-2-enoyl]amino]thiophene-2,4-dicarboxylate (CAS 550316-06-8), with molecular formula C22H24N2O7S and molecular weight 460.13 g/mol. IUPAC: dipropan-2-yl 3-methyl-5-[[(E)-3-(3-nitrophenyl)prop-2-enoyl]amino]thiophene-2,4-dicarboxylate.
Chemical Property Profile of dipropan-2-yl 3-methyl-5-[[(E)-3-(3-nitrophenyl)prop-2-enoyl]amino]thiophene-2,4-dicarboxylate
Property Insights of dipropan-2-yl 3-methyl-5-[[(E)-3-(3-nitrophenyl)prop-2-enoyl]amino]thiophene-2,4-dicarboxylate
The XLogP value of 4.74702 indicates that dipropan-2-yl 3-methyl-5-[[(E)-3-(3-nitrophenyl)prop-2-enoyl]amino]thiophene-2,4-dicarboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 124.84 Ų falls within the moderate polarity range, balancing permeability and solubility for dipropan-2-yl 3-methyl-5-[[(E)-3-(3-nitrophenyl)prop-2-enoyl]amino]thiophene-2,4-dicarboxylate. Following Lipinski's Rule of Five, dipropan-2-yl 3-methyl-5-[[(E)-3-(3-nitrophenyl)prop-2-enoyl]amino]thiophene-2,4-dicarboxylate has 1 hydrogen bond donor(s) and 8 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 dipropan-2-yl 3-methyl-5-[[(E)-3-(3-nitrophenyl)prop-2-enoyl]amino]thiophene-2,4-dicarboxylate?
The CAS number of dipropan-2-yl 3-methyl-5-[[(E)-3-(3-nitrophenyl)prop-2-enoyl]amino]thiophene-2,4-dicarboxylate is 550316-06-8.
What is the molecular formula of dipropan-2-yl 3-methyl-5-[[(E)-3-(3-nitrophenyl)prop-2-enoyl]amino]thiophene-2,4-dicarboxylate?
The molecular formula of dipropan-2-yl 3-methyl-5-[[(E)-3-(3-nitrophenyl)prop-2-enoyl]amino]thiophene-2,4-dicarboxylate is C22H24N2O7S.
What is the molecular weight of dipropan-2-yl 3-methyl-5-[[(E)-3-(3-nitrophenyl)prop-2-enoyl]amino]thiophene-2,4-dicarboxylate?
The molecular weight of dipropan-2-yl 3-methyl-5-[[(E)-3-(3-nitrophenyl)prop-2-enoyl]amino]thiophene-2,4-dicarboxylate is 460.13 g/mol.
Where can I buy dipropan-2-yl 3-methyl-5-[[(E)-3-(3-nitrophenyl)prop-2-enoyl]amino]thiophene-2,4-dicarboxylate?
You can request a quote for dipropan-2-yl 3-methyl-5-[[(E)-3-(3-nitrophenyl)prop-2-enoyl]amino]thiophene-2,4-dicarboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for dipropan-2-yl 3-methyl-5-[[(E)-3-(3-nitrophenyl)prop-2-enoyl]amino]thiophene-2,4-dicarboxylate?
Yes, KEHONG BIO provides custom synthesis services for dipropan-2-yl 3-methyl-5-[[(E)-3-(3-nitrophenyl)prop-2-enoyl]amino]thiophene-2,4-dicarboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.