![3-chloro-N-[2-chloro-5-(propanoylamino)phenyl]-1-benzothiophene-2-carboxamide structure](/static/products/6944/694450-70-9.webp)
3-chloro-N-[2-chloro-5-(propanoylamino)phenyl]-1-benzothiophene-2-carboxamide
TL;DR: 3-chloro-N-[2-chloro-5-(propanoylamino)phenyl]-1-benzothiophene-2-carboxamide (CAS 694450-70-9) is a chemical compound with molecular formula C18H14Cl2N2O2S and molecular weight 392.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-chloro-N-[2-chloro-5-(propanoylamino)phenyl]-1-benzothiophene-2-carboxamide
Also Known As: BAS 09110319, VU0047149-1, AP-970/42768343, 3-chloro-N-[2-chloro-5-(propanoylamino)phenyl]-1-benzothiophene-2-carboxamide, 3-chloro-N-[2-chloro-5-(propionylamino)phenyl]-1-benzothiophene-2-carboxamide
| Molecular Formula | C18H14Cl2N2O2S |
|---|---|
| Molecular Weight | 392.02 g/mol |
| LogP | 5.8089 |
| Topological Polar Surface Area | 58.2 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 392.0153 |
| Heavy Atoms | 25 |
| Complexity | 968.8645 |
Chemical Identifiers
| CAS Number | 694450-70-9 |
|---|---|
| SMILES | CCC(=O)NC1=CC(=C(C=C1)Cl)NC(=O)C2=C(C3=CC=CC=C3S2)Cl |
Product Overview
3-chloro-N-[2-chloro-5-(propanoylamino)phenyl]-1-benzothiophene-2-carboxamide (CAS 694450-70-9), with molecular formula C18H14Cl2N2O2S and molecular weight 392.02 g/mol. IUPAC: 3-chloro-N-[2-chloro-5-(propanoylamino)phenyl]-1-benzothiophene-2-carboxamide.
Chemical Property Profile of 3-chloro-N-[2-chloro-5-(propanoylamino)phenyl]-1-benzothiophene-2-carboxamide
Property Insights of 3-chloro-N-[2-chloro-5-(propanoylamino)phenyl]-1-benzothiophene-2-carboxamide
The XLogP value of 5.8089 indicates that 3-chloro-N-[2-chloro-5-(propanoylamino)phenyl]-1-benzothiophene-2-carboxamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 58.2 Ų, 3-chloro-N-[2-chloro-5-(propanoylamino)phenyl]-1-benzothiophene-2-carboxamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-chloro-N-[2-chloro-5-(propanoylamino)phenyl]-1-benzothiophene-2-carboxamide has 2 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 3-chloro-N-[2-chloro-5-(propanoylamino)phenyl]-1-benzothiophene-2-carboxamide?
The CAS number of 3-chloro-N-[2-chloro-5-(propanoylamino)phenyl]-1-benzothiophene-2-carboxamide is 694450-70-9.
What is the molecular formula of 3-chloro-N-[2-chloro-5-(propanoylamino)phenyl]-1-benzothiophene-2-carboxamide?
The molecular formula of 3-chloro-N-[2-chloro-5-(propanoylamino)phenyl]-1-benzothiophene-2-carboxamide is C18H14Cl2N2O2S.
What is the molecular weight of 3-chloro-N-[2-chloro-5-(propanoylamino)phenyl]-1-benzothiophene-2-carboxamide?
The molecular weight of 3-chloro-N-[2-chloro-5-(propanoylamino)phenyl]-1-benzothiophene-2-carboxamide is 392.02 g/mol.
Where can I buy 3-chloro-N-[2-chloro-5-(propanoylamino)phenyl]-1-benzothiophene-2-carboxamide?
You can request a quote for 3-chloro-N-[2-chloro-5-(propanoylamino)phenyl]-1-benzothiophene-2-carboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-chloro-N-[2-chloro-5-(propanoylamino)phenyl]-1-benzothiophene-2-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for 3-chloro-N-[2-chloro-5-(propanoylamino)phenyl]-1-benzothiophene-2-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.