[4-(4-Methylsulfonylpiperazin-1-yl)-3-nitrophenyl]-morpholin-4-ylmethanone
TL;DR: [4-(4-Methylsulfonylpiperazin-1-yl)-3-nitrophenyl]-morpholin-4-ylmethanone (CAS 642430-81-7) is a chemical compound with molecular formula C16H22N4O6S and molecular weight 398.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[4-(4-methylsulfonylpiperazin-1-yl)-3-nitrophenyl]-morpholin-4-ylmethanone
Also Known As: [4-(4-methylsulfonylpiperazin-1-yl)-3-nitrophenyl]-morpholin-4-ylmethanone|4-{4-[4-(methylsulfonyl)-1-piperazinyl]-3-nitrobenzoyl}morpholine|(4-(4-(methylsulfonyl)piperazin-1-yl)-3-nitrophenyl)(morpholino)methanone|[4-(4-methylsulfonylpiperazin-1-yl)-3-nitro-phenyl]-morpholin-4-yl-methanone|{4-[4-(methylsulfonyl)piperazin-1-yl]-3-nitrophenyl}(morpholin-4-yl)methanone|MLS000621457|SMR000299548
| Molecular Formula | C16H22N4O6S |
|---|---|
| Molecular Weight | 398.13 g/mol |
| LogP | 0.1488 |
| Topological Polar Surface Area | 113.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 398.126 |
| Heavy Atoms | 27 |
| Complexity | 829.3123 |
Chemical Identifiers
| CAS Number | 642430-81-7 |
|---|---|
| SMILES | CS(=O)(=O)N1CCN(CC1)C2=C(C=C(C=C2)C(=O)N3CCOCC3)[N+](=O)[O-] |
Product Overview
[4-(4-Methylsulfonylpiperazin-1-yl)-3-nitrophenyl]-morpholin-4-ylmethanone (CAS 642430-81-7), with molecular formula C16H22N4O6S and molecular weight 398.13 g/mol. IUPAC: [4-(4-methylsulfonylpiperazin-1-yl)-3-nitrophenyl]-morpholin-4-ylmethanone.
Chemical Property Profile of [4-(4-Methylsulfonylpiperazin-1-yl)-3-nitrophenyl]-morpholin-4-ylmethanone
Property Insights of [4-(4-Methylsulfonylpiperazin-1-yl)-3-nitrophenyl]-morpholin-4-ylmethanone
The XLogP value of 0.1488 suggests moderate lipophilicity, balancing water solubility and membrane permeability for [4-(4-Methylsulfonylpiperazin-1-yl)-3-nitrophenyl]-morpholin-4-ylmethanone. The TPSA of 113.3 Ų falls within the moderate polarity range, balancing permeability and solubility for [4-(4-Methylsulfonylpiperazin-1-yl)-3-nitrophenyl]-morpholin-4-ylmethanone. Following Lipinski's Rule of Five, [4-(4-Methylsulfonylpiperazin-1-yl)-3-nitrophenyl]-morpholin-4-ylmethanone has 0 hydrogen bond donor(s) and 7 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-(4-Methylsulfonylpiperazin-1-yl)-3-nitrophenyl]-morpholin-4-ylmethanone?
The CAS number of [4-(4-Methylsulfonylpiperazin-1-yl)-3-nitrophenyl]-morpholin-4-ylmethanone is 642430-81-7.
What is the molecular formula of [4-(4-Methylsulfonylpiperazin-1-yl)-3-nitrophenyl]-morpholin-4-ylmethanone?
The molecular formula of [4-(4-Methylsulfonylpiperazin-1-yl)-3-nitrophenyl]-morpholin-4-ylmethanone is C16H22N4O6S.
What is the molecular weight of [4-(4-Methylsulfonylpiperazin-1-yl)-3-nitrophenyl]-morpholin-4-ylmethanone?
The molecular weight of [4-(4-Methylsulfonylpiperazin-1-yl)-3-nitrophenyl]-morpholin-4-ylmethanone is 398.13 g/mol.
Where can I buy [4-(4-Methylsulfonylpiperazin-1-yl)-3-nitrophenyl]-morpholin-4-ylmethanone?
You can request a quote for [4-(4-Methylsulfonylpiperazin-1-yl)-3-nitrophenyl]-morpholin-4-ylmethanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [4-(4-Methylsulfonylpiperazin-1-yl)-3-nitrophenyl]-morpholin-4-ylmethanone?
Yes, KEHONG BIO provides custom synthesis services for [4-(4-Methylsulfonylpiperazin-1-yl)-3-nitrophenyl]-morpholin-4-ylmethanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.