6-Benzenesulfonyl-2-sec-butoxy-pyrimidin-4-ylamine
TL;DR: 6-Benzenesulfonyl-2-sec-butoxy-pyrimidin-4-ylamine (CAS 286-43-1) is a chemical compound with molecular formula C14H17N3O3S and molecular weight 307.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-(benzenesulfonyl)-2-butan-2-yloxypyrimidin-4-amine
Also Known As: 6-Benzenesulfonyl-2-sec-butoxy-pyrimidin-4-ylamine, J1.320.183H, 2-(sec-Butoxy)-6-(phenylsulfonyl)pyrimidin-4-amine, 4-Pyrimidinamine, 2-(1-methylpropoxy)-6-(phenylsulfonyl)-, 2-(1-methylpropoxy)-6-(phenylsulfonyl)pyrimidin-4-amine
| Molecular Formula | C14H17N3O3S |
|---|---|
| Molecular Weight | 307.10 g/mol |
| LogP | 2.6 |
| Topological Polar Surface Area | 104.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 307.09906 |
| Heavy Atoms | 21 |
| Complexity | 418.0 |
Chemical Identifiers
| CAS Number | 286-43-1 |
|---|---|
| SMILES | CCC(C)OC1=NC(=CC(=N1)S(=O)(=O)C2=CC=CC=C2)N |
| InChIKey | CQIBKNIQFCCAEK-UHFFFAOYSA-N |
Product Overview
6-Benzenesulfonyl-2-sec-butoxy-pyrimidin-4-ylamine (CAS 286-43-1), with molecular formula C14H17N3O3S and molecular weight 307.10 g/mol. IUPAC: 6-(benzenesulfonyl)-2-butan-2-yloxypyrimidin-4-amine.
Chemical Property Profile of 6-Benzenesulfonyl-2-sec-butoxy-pyrimidin-4-ylamine
Property Insights of 6-Benzenesulfonyl-2-sec-butoxy-pyrimidin-4-ylamine
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6-Benzenesulfonyl-2-sec-butoxy-pyrimidin-4-ylamine. The TPSA of 104.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 6-Benzenesulfonyl-2-sec-butoxy-pyrimidin-4-ylamine. Following Lipinski's Rule of Five, 6-Benzenesulfonyl-2-sec-butoxy-pyrimidin-4-ylamine 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 6-Benzenesulfonyl-2-sec-butoxy-pyrimidin-4-ylamine?
The CAS number of 6-Benzenesulfonyl-2-sec-butoxy-pyrimidin-4-ylamine is 286-43-1.
What is the molecular formula of 6-Benzenesulfonyl-2-sec-butoxy-pyrimidin-4-ylamine?
The molecular formula of 6-Benzenesulfonyl-2-sec-butoxy-pyrimidin-4-ylamine is C14H17N3O3S.
What is the molecular weight of 6-Benzenesulfonyl-2-sec-butoxy-pyrimidin-4-ylamine?
The molecular weight of 6-Benzenesulfonyl-2-sec-butoxy-pyrimidin-4-ylamine is 307.10 g/mol.
Where can I buy 6-Benzenesulfonyl-2-sec-butoxy-pyrimidin-4-ylamine?
You can request a quote for 6-Benzenesulfonyl-2-sec-butoxy-pyrimidin-4-ylamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-Benzenesulfonyl-2-sec-butoxy-pyrimidin-4-ylamine?
Yes, KEHONG BIO provides custom synthesis services for 6-Benzenesulfonyl-2-sec-butoxy-pyrimidin-4-ylamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.