RefChem:1056432
TL;DR: RefChem:1056432 (CAS 67041-20-7) is a chemical compound with molecular formula C21H24N4O3 and molecular weight 380.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(E)-1,3-benzodioxol-5-ylmethylideneamino]-2-[4-(3-methylphenyl)piperazin-1-yl]acetamide
Also Known As: 4-(m-Tolyl)-1-piperazineacetic acid (1,3-benzodioxol-5-ylmethylene)hydrazide, 1-Piperazineacetic acid, 4-(3-methylphenyl)-, (1,3-benzodioxol-5-ylmethylene)hydrazide, RefChem:1056432, BRN 0860150
| Molecular Formula | C21H24N4O3 |
|---|---|
| Molecular Weight | 380.18 g/mol |
| LogP | 1.99602 |
| Topological Polar Surface Area | 66.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 380.18484 |
| Heavy Atoms | 28 |
| Complexity | 875.70447 |
Chemical Identifiers
| CAS Number | 67041-20-7 |
|---|---|
| SMILES | CC1=CC(=CC=C1)N2CCN(CC2)CC(=O)N/N=C/C3=CC4=C(C=C3)OCO4 |
Product Overview
RefChem:1056432 (CAS 67041-20-7), with molecular formula C21H24N4O3 and molecular weight 380.18 g/mol. IUPAC: N-[(E)-1,3-benzodioxol-5-ylmethylideneamino]-2-[4-(3-methylphenyl)piperazin-1-yl]acetamide.
Chemical Property Profile of RefChem:1056432
Property Insights of RefChem:1056432
The XLogP value of 1.99602 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:1056432. The TPSA of 66.4 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:1056432. Following Lipinski's Rule of Five, RefChem:1056432 has 1 hydrogen bond donor(s) and 6 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 RefChem:1056432?
The CAS number of RefChem:1056432 is 67041-20-7.
What is the molecular formula of RefChem:1056432?
The molecular formula of RefChem:1056432 is C21H24N4O3.
What is the molecular weight of RefChem:1056432?
The molecular weight of RefChem:1056432 is 380.18 g/mol.
Where can I buy RefChem:1056432?
You can request a quote for RefChem:1056432 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:1056432?
Yes, KEHONG BIO provides custom synthesis services for RefChem:1056432 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.