![N-[4-(azepan-1-ylsulfonyl)phenyl]-2-(1,3-dioxoisoindol-2-yl)acetamide structure](/static/products/7026/702648-96-2.webp)
N-[4-(azepan-1-ylsulfonyl)phenyl]-2-(1,3-dioxoisoindol-2-yl)acetamide
TL;DR: N-[4-(azepan-1-ylsulfonyl)phenyl]-2-(1,3-dioxoisoindol-2-yl)acetamide (CAS 702648-96-2) is a chemical compound with molecular formula C22H23N3O5S and molecular weight 441.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[4-(azepan-1-ylsulfonyl)phenyl]-2-(1,3-dioxoisoindol-2-yl)acetamide
Also Known As: CBKinase1_005812, CBKinase1_018212, BRD-K31755048-001-01-9, N-[4-(azepan-1-ylsulfonyl)phenyl]-2-(1,3-dioxoisoindol-2-yl)acetamide, N-[4-(azaperhydroepinylsulfonyl)phenyl]-2-(1,3-dioxobenzo[c]azolidin-2-yl)acet amide
| Molecular Formula | C22H23N3O5S |
|---|---|
| Molecular Weight | 441.14 g/mol |
| LogP | 2.486 |
| Topological Polar Surface Area | 103.86 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 441.13583 |
| Heavy Atoms | 31 |
| Complexity | 1085.0903 |
Chemical Identifiers
| CAS Number | 702648-96-2 |
|---|---|
| SMILES | C1CCCN(CC1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)CN3C(=O)C4=CC=CC=C4C3=O |
Product Overview
N-[4-(azepan-1-ylsulfonyl)phenyl]-2-(1,3-dioxoisoindol-2-yl)acetamide (CAS 702648-96-2), with molecular formula C22H23N3O5S and molecular weight 441.14 g/mol. IUPAC: N-[4-(azepan-1-ylsulfonyl)phenyl]-2-(1,3-dioxoisoindol-2-yl)acetamide.
Chemical Property Profile of N-[4-(azepan-1-ylsulfonyl)phenyl]-2-(1,3-dioxoisoindol-2-yl)acetamide
Property Insights of N-[4-(azepan-1-ylsulfonyl)phenyl]-2-(1,3-dioxoisoindol-2-yl)acetamide
The XLogP value of 2.486 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-[4-(azepan-1-ylsulfonyl)phenyl]-2-(1,3-dioxoisoindol-2-yl)acetamide. The TPSA of 103.86 Ų falls within the moderate polarity range, balancing permeability and solubility for N-[4-(azepan-1-ylsulfonyl)phenyl]-2-(1,3-dioxoisoindol-2-yl)acetamide. Following Lipinski's Rule of Five, N-[4-(azepan-1-ylsulfonyl)phenyl]-2-(1,3-dioxoisoindol-2-yl)acetamide has 1 hydrogen bond donor(s) and 5 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 N-[4-(azepan-1-ylsulfonyl)phenyl]-2-(1,3-dioxoisoindol-2-yl)acetamide?
The CAS number of N-[4-(azepan-1-ylsulfonyl)phenyl]-2-(1,3-dioxoisoindol-2-yl)acetamide is 702648-96-2.
What is the molecular formula of N-[4-(azepan-1-ylsulfonyl)phenyl]-2-(1,3-dioxoisoindol-2-yl)acetamide?
The molecular formula of N-[4-(azepan-1-ylsulfonyl)phenyl]-2-(1,3-dioxoisoindol-2-yl)acetamide is C22H23N3O5S.
What is the molecular weight of N-[4-(azepan-1-ylsulfonyl)phenyl]-2-(1,3-dioxoisoindol-2-yl)acetamide?
The molecular weight of N-[4-(azepan-1-ylsulfonyl)phenyl]-2-(1,3-dioxoisoindol-2-yl)acetamide is 441.14 g/mol.
Where can I buy N-[4-(azepan-1-ylsulfonyl)phenyl]-2-(1,3-dioxoisoindol-2-yl)acetamide?
You can request a quote for N-[4-(azepan-1-ylsulfonyl)phenyl]-2-(1,3-dioxoisoindol-2-yl)acetamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[4-(azepan-1-ylsulfonyl)phenyl]-2-(1,3-dioxoisoindol-2-yl)acetamide?
Yes, KEHONG BIO provides custom synthesis services for N-[4-(azepan-1-ylsulfonyl)phenyl]-2-(1,3-dioxoisoindol-2-yl)acetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.