N-(1,1-dioxothiolan-3-yl)-4-(4-methylphenyl)butanamide
TL;DR: N-(1,1-dioxothiolan-3-yl)-4-(4-methylphenyl)butanamide (CAS 878724-85-7) is a chemical compound with molecular formula C15H21NO3S and molecular weight 295.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(1,1-dioxothiolan-3-yl)-4-(4-methylphenyl)butanamide
Also Known As: N-(1,1-dioxothiolan-3-yl)-4-(4-methylphenyl)butanamide, ASN 12770363, VU0509254-1, N-(1,1-dioxidotetrahydrothiophen-3-yl)-4-(p-tolyl)butanamide, F3101-0015
| Molecular Formula | C15H21NO3S |
|---|---|
| Molecular Weight | 295.12 g/mol |
| LogP | 1.62102 |
| Topological Polar Surface Area | 63.24 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 295.1242 |
| Heavy Atoms | 20 |
| Complexity | 563.2864 |
Chemical Identifiers
| CAS Number | 878724-85-7 |
|---|---|
| SMILES | CC1=CC=C(C=C1)CCCC(=O)NC2CCS(=O)(=O)C2 |
Product Overview
N-(1,1-dioxothiolan-3-yl)-4-(4-methylphenyl)butanamide (CAS 878724-85-7), with molecular formula C15H21NO3S and molecular weight 295.12 g/mol. IUPAC: N-(1,1-dioxothiolan-3-yl)-4-(4-methylphenyl)butanamide.
Chemical Property Profile of N-(1,1-dioxothiolan-3-yl)-4-(4-methylphenyl)butanamide
Property Insights of N-(1,1-dioxothiolan-3-yl)-4-(4-methylphenyl)butanamide
The XLogP value of 1.62102 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(1,1-dioxothiolan-3-yl)-4-(4-methylphenyl)butanamide. The TPSA of 63.24 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(1,1-dioxothiolan-3-yl)-4-(4-methylphenyl)butanamide. Following Lipinski's Rule of Five, N-(1,1-dioxothiolan-3-yl)-4-(4-methylphenyl)butanamide has 1 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 N-(1,1-dioxothiolan-3-yl)-4-(4-methylphenyl)butanamide?
The CAS number of N-(1,1-dioxothiolan-3-yl)-4-(4-methylphenyl)butanamide is 878724-85-7.
What is the molecular formula of N-(1,1-dioxothiolan-3-yl)-4-(4-methylphenyl)butanamide?
The molecular formula of N-(1,1-dioxothiolan-3-yl)-4-(4-methylphenyl)butanamide is C15H21NO3S.
What is the molecular weight of N-(1,1-dioxothiolan-3-yl)-4-(4-methylphenyl)butanamide?
The molecular weight of N-(1,1-dioxothiolan-3-yl)-4-(4-methylphenyl)butanamide is 295.12 g/mol.
Where can I buy N-(1,1-dioxothiolan-3-yl)-4-(4-methylphenyl)butanamide?
You can request a quote for N-(1,1-dioxothiolan-3-yl)-4-(4-methylphenyl)butanamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(1,1-dioxothiolan-3-yl)-4-(4-methylphenyl)butanamide?
Yes, KEHONG BIO provides custom synthesis services for N-(1,1-dioxothiolan-3-yl)-4-(4-methylphenyl)butanamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.