4-{2-Methyl-6-[(phenylsulfonyl)methyl]-4-pyrimidinyl}morpholine
TL;DR: 4-{2-Methyl-6-[(phenylsulfonyl)methyl]-4-pyrimidinyl}morpholine (CAS 339278-82-9) is a chemical compound with molecular formula C16H19N3O3S and molecular weight 333.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[6-(benzenesulfonylmethyl)-2-methylpyrimidin-4-yl]morpholine
Also Known As: 4-{2-methyl-6-[(phenylsulfonyl)methyl]-4-pyrimidinyl}morpholine, 4-{6-[(benzenesulfonyl)methyl]-2-methylpyrimidin-4-yl}morpholine, 4-[6-(benzenesulfonylmethyl)-2-methylpyrimidin-4-yl]morpholine, BRD-K32594543-001-03-7
| Molecular Formula | C16H19N3O3S |
|---|---|
| Molecular Weight | 333.11 g/mol |
| LogP | 1.59552 |
| Topological Polar Surface Area | 72.39 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 333.11472 |
| Heavy Atoms | 23 |
| Complexity | 772.4124 |
Chemical Identifiers
| CAS Number | 339278-82-9 |
|---|---|
| SMILES | CC1=NC(=CC(=N1)N2CCOCC2)CS(=O)(=O)C3=CC=CC=C3 |
Product Overview
4-{2-Methyl-6-[(phenylsulfonyl)methyl]-4-pyrimidinyl}morpholine (CAS 339278-82-9), with molecular formula C16H19N3O3S and molecular weight 333.11 g/mol. IUPAC: 4-[6-(benzenesulfonylmethyl)-2-methylpyrimidin-4-yl]morpholine.
Chemical Property Profile of 4-{2-Methyl-6-[(phenylsulfonyl)methyl]-4-pyrimidinyl}morpholine
Property Insights of 4-{2-Methyl-6-[(phenylsulfonyl)methyl]-4-pyrimidinyl}morpholine
The XLogP value of 1.59552 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-{2-Methyl-6-[(phenylsulfonyl)methyl]-4-pyrimidinyl}morpholine. The TPSA of 72.39 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-{2-Methyl-6-[(phenylsulfonyl)methyl]-4-pyrimidinyl}morpholine. Following Lipinski's Rule of Five, 4-{2-Methyl-6-[(phenylsulfonyl)methyl]-4-pyrimidinyl}morpholine has 0 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 4-{2-Methyl-6-[(phenylsulfonyl)methyl]-4-pyrimidinyl}morpholine?
The CAS number of 4-{2-Methyl-6-[(phenylsulfonyl)methyl]-4-pyrimidinyl}morpholine is 339278-82-9.
What is the molecular formula of 4-{2-Methyl-6-[(phenylsulfonyl)methyl]-4-pyrimidinyl}morpholine?
The molecular formula of 4-{2-Methyl-6-[(phenylsulfonyl)methyl]-4-pyrimidinyl}morpholine is C16H19N3O3S.
What is the molecular weight of 4-{2-Methyl-6-[(phenylsulfonyl)methyl]-4-pyrimidinyl}morpholine?
The molecular weight of 4-{2-Methyl-6-[(phenylsulfonyl)methyl]-4-pyrimidinyl}morpholine is 333.11 g/mol.
Where can I buy 4-{2-Methyl-6-[(phenylsulfonyl)methyl]-4-pyrimidinyl}morpholine?
You can request a quote for 4-{2-Methyl-6-[(phenylsulfonyl)methyl]-4-pyrimidinyl}morpholine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-{2-Methyl-6-[(phenylsulfonyl)methyl]-4-pyrimidinyl}morpholine?
Yes, KEHONG BIO provides custom synthesis services for 4-{2-Methyl-6-[(phenylsulfonyl)methyl]-4-pyrimidinyl}morpholine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.