n-(4-Chlorophenyl)-4-methylpiperazine-1-carboxamide
TL;DR: n-(4-Chlorophenyl)-4-methylpiperazine-1-carboxamide (CAS 6727-94-2) is a chemical compound with molecular formula C12H16ClN3O and molecular weight 253.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(4-chlorophenyl)-4-methylpiperazine-1-carboxamide
Also Known As: n-(4-chlorophenyl)-4-methylpiperazine-1-carboxamide, N-(4-CHLOROPHENYL)(4-METHYLPIPERAZINYL)FORMAMIDE, N-(4-chlorophenyl)-4-methyl-1-piperazinecarboxamide, N-(4-chlorophenyl)-4-methyl-piperazine-1-carboxamide, N-(4-Chlorophenyl)-4-methylpiperazine-1-carboxamide (4)
| Molecular Formula | C12H16ClN3O |
|---|---|
| Molecular Weight | 253.10 g/mol |
| LogP | 1.5 |
| Topological Polar Surface Area | 35.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 253.09819 |
| Heavy Atoms | 17 |
| Complexity | 258.0 |
Chemical Identifiers
| CAS Number | 6727-94-2 |
|---|---|
| SMILES | CN1CCN(CC1)C(=O)NC2=CC=C(C=C2)Cl |
| InChIKey | MQGGECJYAPJGHK-UHFFFAOYSA-N |
Product Overview
n-(4-Chlorophenyl)-4-methylpiperazine-1-carboxamide (CAS 6727-94-2), with molecular formula C12H16ClN3O and molecular weight 253.10 g/mol. IUPAC: N-(4-chlorophenyl)-4-methylpiperazine-1-carboxamide.
Chemical Property Profile of n-(4-Chlorophenyl)-4-methylpiperazine-1-carboxamide
Property Insights of n-(4-Chlorophenyl)-4-methylpiperazine-1-carboxamide
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for n-(4-Chlorophenyl)-4-methylpiperazine-1-carboxamide. With a topological polar surface area (TPSA) of 35.6 Ų, n-(4-Chlorophenyl)-4-methylpiperazine-1-carboxamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, n-(4-Chlorophenyl)-4-methylpiperazine-1-carboxamide has 1 hydrogen bond donor(s) and 2 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-Chlorophenyl)-4-methylpiperazine-1-carboxamide?
The CAS number of n-(4-Chlorophenyl)-4-methylpiperazine-1-carboxamide is 6727-94-2.
What is the molecular formula of n-(4-Chlorophenyl)-4-methylpiperazine-1-carboxamide?
The molecular formula of n-(4-Chlorophenyl)-4-methylpiperazine-1-carboxamide is C12H16ClN3O.
What is the molecular weight of n-(4-Chlorophenyl)-4-methylpiperazine-1-carboxamide?
The molecular weight of n-(4-Chlorophenyl)-4-methylpiperazine-1-carboxamide is 253.10 g/mol.
Where can I buy n-(4-Chlorophenyl)-4-methylpiperazine-1-carboxamide?
You can request a quote for n-(4-Chlorophenyl)-4-methylpiperazine-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-(4-Chlorophenyl)-4-methylpiperazine-1-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for n-(4-Chlorophenyl)-4-methylpiperazine-1-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.