![3-chloro-N-{4-[(diallylamino)sulfonyl]phenyl}-1-benzothiophene-2-carboxamide structure](/static/products/6205/620581-31-9.webp)
3-chloro-N-{4-[(diallylamino)sulfonyl]phenyl}-1-benzothiophene-2-carboxamide
TL;DR: 3-chloro-N-{4-[(diallylamino)sulfonyl]phenyl}-1-benzothiophene-2-carboxamide (CAS 620581-31-9) is a chemical compound with molecular formula C21H19ClN2O3S2 and molecular weight 446.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[4-[bis(prop-2-enyl)sulfamoyl]phenyl]-3-chloro-1-benzothiophene-2-carboxamide
Also Known As: AN-329/42217159, 3-chloro-N-{4-[(diallylamino)sulfonyl]phenyl}-1-benzothiophene-2-carboxamide, N-[4-[bis(prop-2-enyl)sulfamoyl]phenyl]-3-chloro-1-benzothiophene-2-carboxamide, 3-chloro-N-[4-(diprop-2-en-1-ylsulfamoyl)phenyl]-1-benzothiophene-2-carboxamide
| Molecular Formula | C21H19ClN2O3S2 |
|---|---|
| Molecular Weight | 446.05 g/mol |
| LogP | 5.1697 |
| Topological Polar Surface Area | 66.48 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 8 |
| Exact Mass | 446.05255 |
| Heavy Atoms | 29 |
| Complexity | 1158.3593 |
Chemical Identifiers
| CAS Number | 620581-31-9 |
|---|---|
| SMILES | C=CCN(CC=C)S(=O)(=O)C1=CC=C(C=C1)NC(=O)C2=C(C3=CC=CC=C3S2)Cl |
Product Overview
3-chloro-N-{4-[(diallylamino)sulfonyl]phenyl}-1-benzothiophene-2-carboxamide (CAS 620581-31-9), with molecular formula C21H19ClN2O3S2 and molecular weight 446.05 g/mol. IUPAC: N-[4-[bis(prop-2-enyl)sulfamoyl]phenyl]-3-chloro-1-benzothiophene-2-carboxamide.
Chemical Property Profile of 3-chloro-N-{4-[(diallylamino)sulfonyl]phenyl}-1-benzothiophene-2-carboxamide
Property Insights of 3-chloro-N-{4-[(diallylamino)sulfonyl]phenyl}-1-benzothiophene-2-carboxamide
The XLogP value of 5.1697 indicates that 3-chloro-N-{4-[(diallylamino)sulfonyl]phenyl}-1-benzothiophene-2-carboxamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 66.48 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-chloro-N-{4-[(diallylamino)sulfonyl]phenyl}-1-benzothiophene-2-carboxamide. Following Lipinski's Rule of Five, 3-chloro-N-{4-[(diallylamino)sulfonyl]phenyl}-1-benzothiophene-2-carboxamide has 1 hydrogen bond donor(s) and 4 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-{4-[(diallylamino)sulfonyl]phenyl}-1-benzothiophene-2-carboxamide?
The CAS number of 3-chloro-N-{4-[(diallylamino)sulfonyl]phenyl}-1-benzothiophene-2-carboxamide is 620581-31-9.
What is the molecular formula of 3-chloro-N-{4-[(diallylamino)sulfonyl]phenyl}-1-benzothiophene-2-carboxamide?
The molecular formula of 3-chloro-N-{4-[(diallylamino)sulfonyl]phenyl}-1-benzothiophene-2-carboxamide is C21H19ClN2O3S2.
What is the molecular weight of 3-chloro-N-{4-[(diallylamino)sulfonyl]phenyl}-1-benzothiophene-2-carboxamide?
The molecular weight of 3-chloro-N-{4-[(diallylamino)sulfonyl]phenyl}-1-benzothiophene-2-carboxamide is 446.05 g/mol.
Where can I buy 3-chloro-N-{4-[(diallylamino)sulfonyl]phenyl}-1-benzothiophene-2-carboxamide?
You can request a quote for 3-chloro-N-{4-[(diallylamino)sulfonyl]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-{4-[(diallylamino)sulfonyl]phenyl}-1-benzothiophene-2-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for 3-chloro-N-{4-[(diallylamino)sulfonyl]phenyl}-1-benzothiophene-2-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.