N-cyclohexyl-4-{[(E)-(4-hydroxy-2,6-dioxo-1,6-dihydropyrimidin-5(2H)-ylidene)methyl]amino}-N-methylbenzenesulfonamide
TL;DR: N-cyclohexyl-4-{[(E)-(4-hydroxy-2,6-dioxo-1,6-dihydropyrimidin-5(2H)-ylidene)methyl]amino}-N-methylbenzenesulfonamide (CAS 385375-77-9) is a chemical compound with molecular formula C18H22N4O5S and molecular weight 406.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-cyclohexyl-4-[(6-hydroxy-2,4-dioxo-1H-pyrimidin-5-yl)methylideneamino]-N-methylbenzenesulfonamide
Also Known As: N-cyclohexyl-4-{[(E)-(4-hydroxy-2,6-dioxo-1,6-dihydropyrimidin-5(2H)-ylidene)methyl]amino}-N-methylbenzenesulfonamide, N-cyclohexyl-N-methyl-4-(((2,4,6-trioxotetrahydropyrimidin-5(2H)-ylidene)methyl)amino)benzenesulfonamide, N-cyclohexyl-N-methyl-4-[(2,4,6-trioxo-1,3-diazinan-5-ylidene)methylamino]benzenesulfonamide
| Molecular Formula | C18H22N4O5S |
|---|---|
| Molecular Weight | 406.13 g/mol |
| LogP | 1.4726 |
| Topological Polar Surface Area | 135.69 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 406.1311 |
| Heavy Atoms | 28 |
| Complexity | 1080.1945 |
Chemical Identifiers
| CAS Number | 385375-77-9 |
|---|---|
| SMILES | CN(C1CCCCC1)S(=O)(=O)C2=CC=C(C=C2)N=CC3=C(NC(=O)NC3=O)O |
Product Overview
N-cyclohexyl-4-{[(E)-(4-hydroxy-2,6-dioxo-1,6-dihydropyrimidin-5(2H)-ylidene)methyl]amino}-N-methylbenzenesulfonamide (CAS 385375-77-9), with molecular formula C18H22N4O5S and molecular weight 406.13 g/mol. IUPAC: N-cyclohexyl-4-[(6-hydroxy-2,4-dioxo-1H-pyrimidin-5-yl)methylideneamino]-N-methylbenzenesulfonamide.
Chemical Property Profile of N-cyclohexyl-4-{[(E)-(4-hydroxy-2,6-dioxo-1,6-dihydropyrimidin-5(2H)-ylidene)methyl]amino}-N-methylbenzenesulfonamide
Property Insights of N-cyclohexyl-4-{[(E)-(4-hydroxy-2,6-dioxo-1,6-dihydropyrimidin-5(2H)-ylidene)methyl]amino}-N-methylbenzenesulfonamide
The XLogP value of 1.4726 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-cyclohexyl-4-{[(E)-(4-hydroxy-2,6-dioxo-1,6-dihydropyrimidin-5(2H)-ylidene)methyl]amino}-N-methylbenzenesulfonamide. The TPSA of 135.69 Ų falls within the moderate polarity range, balancing permeability and solubility for N-cyclohexyl-4-{[(E)-(4-hydroxy-2,6-dioxo-1,6-dihydropyrimidin-5(2H)-ylidene)methyl]amino}-N-methylbenzenesulfonamide. Following Lipinski's Rule of Five, N-cyclohexyl-4-{[(E)-(4-hydroxy-2,6-dioxo-1,6-dihydropyrimidin-5(2H)-ylidene)methyl]amino}-N-methylbenzenesulfonamide has 3 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-cyclohexyl-4-{[(E)-(4-hydroxy-2,6-dioxo-1,6-dihydropyrimidin-5(2H)-ylidene)methyl]amino}-N-methylbenzenesulfonamide?
The CAS number of N-cyclohexyl-4-{[(E)-(4-hydroxy-2,6-dioxo-1,6-dihydropyrimidin-5(2H)-ylidene)methyl]amino}-N-methylbenzenesulfonamide is 385375-77-9.
What is the molecular formula of N-cyclohexyl-4-{[(E)-(4-hydroxy-2,6-dioxo-1,6-dihydropyrimidin-5(2H)-ylidene)methyl]amino}-N-methylbenzenesulfonamide?
The molecular formula of N-cyclohexyl-4-{[(E)-(4-hydroxy-2,6-dioxo-1,6-dihydropyrimidin-5(2H)-ylidene)methyl]amino}-N-methylbenzenesulfonamide is C18H22N4O5S.
What is the molecular weight of N-cyclohexyl-4-{[(E)-(4-hydroxy-2,6-dioxo-1,6-dihydropyrimidin-5(2H)-ylidene)methyl]amino}-N-methylbenzenesulfonamide?
The molecular weight of N-cyclohexyl-4-{[(E)-(4-hydroxy-2,6-dioxo-1,6-dihydropyrimidin-5(2H)-ylidene)methyl]amino}-N-methylbenzenesulfonamide is 406.13 g/mol.
Where can I buy N-cyclohexyl-4-{[(E)-(4-hydroxy-2,6-dioxo-1,6-dihydropyrimidin-5(2H)-ylidene)methyl]amino}-N-methylbenzenesulfonamide?
You can request a quote for N-cyclohexyl-4-{[(E)-(4-hydroxy-2,6-dioxo-1,6-dihydropyrimidin-5(2H)-ylidene)methyl]amino}-N-methylbenzenesulfonamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-cyclohexyl-4-{[(E)-(4-hydroxy-2,6-dioxo-1,6-dihydropyrimidin-5(2H)-ylidene)methyl]amino}-N-methylbenzenesulfonamide?
Yes, KEHONG BIO provides custom synthesis services for N-cyclohexyl-4-{[(E)-(4-hydroxy-2,6-dioxo-1,6-dihydropyrimidin-5(2H)-ylidene)methyl]amino}-N-methylbenzenesulfonamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.