![2-[(2E)-3-(2,6-dichlorophenyl)prop-2-enoylamino]-4,5,6,7-tetrahydrobenzo[b]thi ophene-3-carboxamide structure](/static/products/5693/5693-03-8.webp)
2-[(2E)-3-(2,6-dichlorophenyl)prop-2-enoylamino]-4,5,6,7-tetrahydrobenzo[b]thi ophene-3-carboxamide
TL;DR: 2-[(2E)-3-(2,6-dichlorophenyl)prop-2-enoylamino]-4,5,6,7-tetrahydrobenzo[b]thi ophene-3-carboxamide (CAS 5693-03-8) is a chemical compound with molecular formula C18H16Cl2N2O2S and molecular weight 394.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[(E)-3-(2,6-dichlorophenyl)prop-2-enoyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
Also Known As: 2-[(2E)-3-(2,6-dichlorophenyl)prop-2-enoylamino]-4,5,6,7-tetrahydrobenzo[b]thi ophene-3-carboxamide, 2-[[(E)-3-(2,6-dichlorophenyl)prop-2-enoyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide, 2-{[(2E)-3-(2,6-dichlorophenyl)prop-2-enoyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
| Molecular Formula | C18H16Cl2N2O2S |
|---|---|
| Molecular Weight | 394.03 g/mol |
| LogP | 4.6845 |
| Topological Polar Surface Area | 72.19 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 394.03094 |
| Heavy Atoms | 25 |
| Complexity | 853.9513 |
Chemical Identifiers
| CAS Number | 5693-03-8 |
|---|---|
| SMILES | C1CCC2=C(C1)C(=C(S2)NC(=O)/C=C/C3=C(C=CC=C3Cl)Cl)C(=O)N |
Product Overview
2-[(2E)-3-(2,6-dichlorophenyl)prop-2-enoylamino]-4,5,6,7-tetrahydrobenzo[b]thi ophene-3-carboxamide (CAS 5693-03-8), with molecular formula C18H16Cl2N2O2S and molecular weight 394.03 g/mol. IUPAC: 2-[[(E)-3-(2,6-dichlorophenyl)prop-2-enoyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide.
Chemical Property Profile of 2-[(2E)-3-(2,6-dichlorophenyl)prop-2-enoylamino]-4,5,6,7-tetrahydrobenzo[b]thi ophene-3-carboxamide
Property Insights of 2-[(2E)-3-(2,6-dichlorophenyl)prop-2-enoylamino]-4,5,6,7-tetrahydrobenzo[b]thi ophene-3-carboxamide
The XLogP value of 4.6845 indicates that 2-[(2E)-3-(2,6-dichlorophenyl)prop-2-enoylamino]-4,5,6,7-tetrahydrobenzo[b]thi ophene-3-carboxamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 72.19 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-[(2E)-3-(2,6-dichlorophenyl)prop-2-enoylamino]-4,5,6,7-tetrahydrobenzo[b]thi ophene-3-carboxamide. Following Lipinski's Rule of Five, 2-[(2E)-3-(2,6-dichlorophenyl)prop-2-enoylamino]-4,5,6,7-tetrahydrobenzo[b]thi ophene-3-carboxamide has 2 hydrogen bond donor(s) and 3 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-[(2E)-3-(2,6-dichlorophenyl)prop-2-enoylamino]-4,5,6,7-tetrahydrobenzo[b]thi ophene-3-carboxamide?
The CAS number of 2-[(2E)-3-(2,6-dichlorophenyl)prop-2-enoylamino]-4,5,6,7-tetrahydrobenzo[b]thi ophene-3-carboxamide is 5693-03-8.
What is the molecular formula of 2-[(2E)-3-(2,6-dichlorophenyl)prop-2-enoylamino]-4,5,6,7-tetrahydrobenzo[b]thi ophene-3-carboxamide?
The molecular formula of 2-[(2E)-3-(2,6-dichlorophenyl)prop-2-enoylamino]-4,5,6,7-tetrahydrobenzo[b]thi ophene-3-carboxamide is C18H16Cl2N2O2S.
What is the molecular weight of 2-[(2E)-3-(2,6-dichlorophenyl)prop-2-enoylamino]-4,5,6,7-tetrahydrobenzo[b]thi ophene-3-carboxamide?
The molecular weight of 2-[(2E)-3-(2,6-dichlorophenyl)prop-2-enoylamino]-4,5,6,7-tetrahydrobenzo[b]thi ophene-3-carboxamide is 394.03 g/mol.
Where can I buy 2-[(2E)-3-(2,6-dichlorophenyl)prop-2-enoylamino]-4,5,6,7-tetrahydrobenzo[b]thi ophene-3-carboxamide?
You can request a quote for 2-[(2E)-3-(2,6-dichlorophenyl)prop-2-enoylamino]-4,5,6,7-tetrahydrobenzo[b]thi ophene-3-carboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[(2E)-3-(2,6-dichlorophenyl)prop-2-enoylamino]-4,5,6,7-tetrahydrobenzo[b]thi ophene-3-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for 2-[(2E)-3-(2,6-dichlorophenyl)prop-2-enoylamino]-4,5,6,7-tetrahydrobenzo[b]thi ophene-3-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.