N-(3,4-dimethylphenyl)-4-methylsulfonylpiperazine-1-carboxamide
TL;DR: N-(3,4-dimethylphenyl)-4-methylsulfonylpiperazine-1-carboxamide (CAS 897332-17-1) is a chemical compound with molecular formula C14H21N3O3S and molecular weight 311.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(3,4-dimethylphenyl)-4-methylsulfonylpiperazine-1-carboxamide
Also Known As: N-(3,4-dimethylphenyl)-4-methylsulfonylpiperazine-1-carboxamide, N-(3,4-dimethylphenyl)-4-methylsulfonyl-piperazine-1-carboxamide, N-(3,4-dimethylphenyl)[4-(methylsulfonyl)piperazinyl]carboxamide, N-(3,4-DIMETHYLPHENYL)-4-(METHYLSULFONYL)-1-PIPERAZINECARBOXAMIDE
| Molecular Formula | C14H21N3O3S |
|---|---|
| Molecular Weight | 311.13 g/mol |
| LogP | 1.41254 |
| Topological Polar Surface Area | 69.72 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 311.13037 |
| Heavy Atoms | 21 |
| Complexity | 634.8644 |
Chemical Identifiers
| CAS Number | 897332-17-1 |
|---|---|
| SMILES | CC1=C(C=C(C=C1)NC(=O)N2CCN(CC2)S(=O)(=O)C)C |
Product Overview
N-(3,4-dimethylphenyl)-4-methylsulfonylpiperazine-1-carboxamide (CAS 897332-17-1), with molecular formula C14H21N3O3S and molecular weight 311.13 g/mol. IUPAC: N-(3,4-dimethylphenyl)-4-methylsulfonylpiperazine-1-carboxamide.
Chemical Property Profile of N-(3,4-dimethylphenyl)-4-methylsulfonylpiperazine-1-carboxamide
Property Insights of N-(3,4-dimethylphenyl)-4-methylsulfonylpiperazine-1-carboxamide
The XLogP value of 1.41254 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(3,4-dimethylphenyl)-4-methylsulfonylpiperazine-1-carboxamide. The TPSA of 69.72 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(3,4-dimethylphenyl)-4-methylsulfonylpiperazine-1-carboxamide. Following Lipinski's Rule of Five, N-(3,4-dimethylphenyl)-4-methylsulfonylpiperazine-1-carboxamide 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-(3,4-dimethylphenyl)-4-methylsulfonylpiperazine-1-carboxamide?
The CAS number of N-(3,4-dimethylphenyl)-4-methylsulfonylpiperazine-1-carboxamide is 897332-17-1.
What is the molecular formula of N-(3,4-dimethylphenyl)-4-methylsulfonylpiperazine-1-carboxamide?
The molecular formula of N-(3,4-dimethylphenyl)-4-methylsulfonylpiperazine-1-carboxamide is C14H21N3O3S.
What is the molecular weight of N-(3,4-dimethylphenyl)-4-methylsulfonylpiperazine-1-carboxamide?
The molecular weight of N-(3,4-dimethylphenyl)-4-methylsulfonylpiperazine-1-carboxamide is 311.13 g/mol.
Where can I buy N-(3,4-dimethylphenyl)-4-methylsulfonylpiperazine-1-carboxamide?
You can request a quote for N-(3,4-dimethylphenyl)-4-methylsulfonylpiperazine-1-carboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(3,4-dimethylphenyl)-4-methylsulfonylpiperazine-1-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for N-(3,4-dimethylphenyl)-4-methylsulfonylpiperazine-1-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.