N-((1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydropyrimidin-4-yl)methyl)-3,5-dimethylisoxazole-4-sulfonamide
TL;DR: N-((1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydropyrimidin-4-yl)methyl)-3,5-dimethylisoxazole-4-sulfonamide (CAS 899378-13-3) is a chemical compound with molecular formula C12H16N4O5S and molecular weight 328.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(1,3-dimethyl-2,6-dioxopyrimidin-4-yl)methyl]-3,5-dimethyl-1,2-oxazole-4-sulfonamide
Also Known As: N-((1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydropyrimidin-4-yl)methyl)-3,5-dimethylisoxazole-4-sulfonamide, N-[(1,3-dimethyl-2,6-dioxopyrimidin-4-yl)methyl]-3,5-dimethyl-1,2-oxazole-4-sulfonamide, N-[(1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydropyrimidin-4-yl)methyl]-3,5-dimethyl-1,2-oxazole-4-sulfonamide
| Molecular Formula | C12H16N4O5S |
|---|---|
| Molecular Weight | 328.08 g/mol |
| LogP | -0.83266 |
| Topological Polar Surface Area | 116.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 328.08414 |
| Heavy Atoms | 22 |
| Complexity | 915.90186 |
Chemical Identifiers
| CAS Number | 899378-13-3 |
|---|---|
| SMILES | CC1=C(C(=NO1)C)S(=O)(=O)NCC2=CC(=O)N(C(=O)N2C)C |
Product Overview
N-((1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydropyrimidin-4-yl)methyl)-3,5-dimethylisoxazole-4-sulfonamide (CAS 899378-13-3), with molecular formula C12H16N4O5S and molecular weight 328.08 g/mol. IUPAC: N-[(1,3-dimethyl-2,6-dioxopyrimidin-4-yl)methyl]-3,5-dimethyl-1,2-oxazole-4-sulfonamide.
Chemical Property Profile of N-((1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydropyrimidin-4-yl)methyl)-3,5-dimethylisoxazole-4-sulfonamide
Property Insights of N-((1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydropyrimidin-4-yl)methyl)-3,5-dimethylisoxazole-4-sulfonamide
The XLogP value of -0.83266 indicates that N-((1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydropyrimidin-4-yl)methyl)-3,5-dimethylisoxazole-4-sulfonamide is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 116.2 Ų falls within the moderate polarity range, balancing permeability and solubility for N-((1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydropyrimidin-4-yl)methyl)-3,5-dimethylisoxazole-4-sulfonamide. Following Lipinski's Rule of Five, N-((1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydropyrimidin-4-yl)methyl)-3,5-dimethylisoxazole-4-sulfonamide 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 N-((1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydropyrimidin-4-yl)methyl)-3,5-dimethylisoxazole-4-sulfonamide?
The CAS number of N-((1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydropyrimidin-4-yl)methyl)-3,5-dimethylisoxazole-4-sulfonamide is 899378-13-3.
What is the molecular formula of N-((1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydropyrimidin-4-yl)methyl)-3,5-dimethylisoxazole-4-sulfonamide?
The molecular formula of N-((1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydropyrimidin-4-yl)methyl)-3,5-dimethylisoxazole-4-sulfonamide is C12H16N4O5S.
What is the molecular weight of N-((1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydropyrimidin-4-yl)methyl)-3,5-dimethylisoxazole-4-sulfonamide?
The molecular weight of N-((1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydropyrimidin-4-yl)methyl)-3,5-dimethylisoxazole-4-sulfonamide is 328.08 g/mol.
Where can I buy N-((1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydropyrimidin-4-yl)methyl)-3,5-dimethylisoxazole-4-sulfonamide?
You can request a quote for N-((1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydropyrimidin-4-yl)methyl)-3,5-dimethylisoxazole-4-sulfonamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-((1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydropyrimidin-4-yl)methyl)-3,5-dimethylisoxazole-4-sulfonamide?
Yes, KEHONG BIO provides custom synthesis services for N-((1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydropyrimidin-4-yl)methyl)-3,5-dimethylisoxazole-4-sulfonamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.