4-[2-[4-(2,3-Dimethylphenyl)piperazin-1-yl]-2-oxoethyl]-1,4-benzoxazin-3-one
TL;DR: 4-[2-[4-(2,3-Dimethylphenyl)piperazin-1-yl]-2-oxoethyl]-1,4-benzoxazin-3-one (CAS 606118-30-3) is a chemical compound with molecular formula C22H25N3O3 and molecular weight 379.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[2-[4-(2,3-dimethylphenyl)piperazin-1-yl]-2-oxoethyl]-1,4-benzoxazin-3-one
Also Known As: ASN 06911615, 4-{2-[4-(2,3-Dimethylphenyl)-1-piperazinyl]-2-oxoethyl}-2H-1,4-benzoxazin-3(4H)-one, 4-[2-[4-(2,3-dimethylphenyl)piperazin-1-yl]-2-oxoethyl]-1,4-benzoxazin-3-one, PIPERAZINE, 1-[(2,3-DIHYDRO-3-OXO-4H-1,4-BENZOXAZIN-4-YL)ACETYL]-4-(2,3-DIMETHYLPHENYL)-
| Molecular Formula | C22H25N3O3 |
|---|---|
| Molecular Weight | 379.19 g/mol |
| LogP | 2.37764 |
| Topological Polar Surface Area | 53.09 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 379.1896 |
| Heavy Atoms | 28 |
| Complexity | 903.65 |
Chemical Identifiers
| CAS Number | 606118-30-3 |
|---|---|
| SMILES | CC1=C(C(=CC=C1)N2CCN(CC2)C(=O)CN3C(=O)COC4=CC=CC=C43)C |
Product Overview
4-[2-[4-(2,3-Dimethylphenyl)piperazin-1-yl]-2-oxoethyl]-1,4-benzoxazin-3-one (CAS 606118-30-3), with molecular formula C22H25N3O3 and molecular weight 379.19 g/mol. IUPAC: 4-[2-[4-(2,3-dimethylphenyl)piperazin-1-yl]-2-oxoethyl]-1,4-benzoxazin-3-one.
Chemical Property Profile of 4-[2-[4-(2,3-Dimethylphenyl)piperazin-1-yl]-2-oxoethyl]-1,4-benzoxazin-3-one
Property Insights of 4-[2-[4-(2,3-Dimethylphenyl)piperazin-1-yl]-2-oxoethyl]-1,4-benzoxazin-3-one
The XLogP value of 2.37764 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-[2-[4-(2,3-Dimethylphenyl)piperazin-1-yl]-2-oxoethyl]-1,4-benzoxazin-3-one. With a topological polar surface area (TPSA) of 53.09 Ų, 4-[2-[4-(2,3-Dimethylphenyl)piperazin-1-yl]-2-oxoethyl]-1,4-benzoxazin-3-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-[2-[4-(2,3-Dimethylphenyl)piperazin-1-yl]-2-oxoethyl]-1,4-benzoxazin-3-one has 0 hydrogen bond donor(s) and 4 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 4-[2-[4-(2,3-Dimethylphenyl)piperazin-1-yl]-2-oxoethyl]-1,4-benzoxazin-3-one?
The CAS number of 4-[2-[4-(2,3-Dimethylphenyl)piperazin-1-yl]-2-oxoethyl]-1,4-benzoxazin-3-one is 606118-30-3.
What is the molecular formula of 4-[2-[4-(2,3-Dimethylphenyl)piperazin-1-yl]-2-oxoethyl]-1,4-benzoxazin-3-one?
The molecular formula of 4-[2-[4-(2,3-Dimethylphenyl)piperazin-1-yl]-2-oxoethyl]-1,4-benzoxazin-3-one is C22H25N3O3.
What is the molecular weight of 4-[2-[4-(2,3-Dimethylphenyl)piperazin-1-yl]-2-oxoethyl]-1,4-benzoxazin-3-one?
The molecular weight of 4-[2-[4-(2,3-Dimethylphenyl)piperazin-1-yl]-2-oxoethyl]-1,4-benzoxazin-3-one is 379.19 g/mol.
Where can I buy 4-[2-[4-(2,3-Dimethylphenyl)piperazin-1-yl]-2-oxoethyl]-1,4-benzoxazin-3-one?
You can request a quote for 4-[2-[4-(2,3-Dimethylphenyl)piperazin-1-yl]-2-oxoethyl]-1,4-benzoxazin-3-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-[2-[4-(2,3-Dimethylphenyl)piperazin-1-yl]-2-oxoethyl]-1,4-benzoxazin-3-one?
Yes, KEHONG BIO provides custom synthesis services for 4-[2-[4-(2,3-Dimethylphenyl)piperazin-1-yl]-2-oxoethyl]-1,4-benzoxazin-3-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.