![4-chloro-N-[(1,3-dimethyl-2,6-dioxopyrimidin-4-yl)carbamothioyl]benzamide structure](/static/products/488/488732-85-0.png)
4-chloro-N-[(1,3-dimethyl-2,6-dioxopyrimidin-4-yl)carbamothioyl]benzamide
TL;DR: 4-chloro-N-[(1,3-dimethyl-2,6-dioxopyrimidin-4-yl)carbamothioyl]benzamide (CAS 488732-85-0) is a chemical compound with molecular formula C14H13ClN4O3S and molecular weight 352.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-chloro-N-[(1,3-dimethyl-2,6-dioxopyrimidin-4-yl)carbamothioyl]benzamide
Also Known As: 4-chloro-N-[(1,3-dimethyl-2,6-dioxopyrimidin-4-yl)carbamothioyl]benzamide, 4-chloro-N-((1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydropyrimidin-4-yl)carbamothioyl)benzamide, 4-chloro-N-[(1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydropyrimidin-4-yl)carbamothioyl]benzamide
| Molecular Formula | C14H13ClN4O3S |
|---|---|
| Molecular Weight | 352.04 g/mol |
| LogP | 0.8642 |
| Topological Polar Surface Area | 85.13 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 352.0397 |
| Heavy Atoms | 23 |
| Complexity | 886.37585 |
Chemical Identifiers
| CAS Number | 488732-85-0 |
|---|---|
| SMILES | CN1C(=CC(=O)N(C1=O)C)NC(=S)NC(=O)C2=CC=C(C=C2)Cl |
Product Overview
4-chloro-N-[(1,3-dimethyl-2,6-dioxopyrimidin-4-yl)carbamothioyl]benzamide (CAS 488732-85-0), with molecular formula C14H13ClN4O3S and molecular weight 352.04 g/mol. IUPAC: 4-chloro-N-[(1,3-dimethyl-2,6-dioxopyrimidin-4-yl)carbamothioyl]benzamide.
Chemical Property Profile of 4-chloro-N-[(1,3-dimethyl-2,6-dioxopyrimidin-4-yl)carbamothioyl]benzamide
Property Insights of 4-chloro-N-[(1,3-dimethyl-2,6-dioxopyrimidin-4-yl)carbamothioyl]benzamide
The XLogP value of 0.8642 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-chloro-N-[(1,3-dimethyl-2,6-dioxopyrimidin-4-yl)carbamothioyl]benzamide. The TPSA of 85.13 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-chloro-N-[(1,3-dimethyl-2,6-dioxopyrimidin-4-yl)carbamothioyl]benzamide. Following Lipinski's Rule of Five, 4-chloro-N-[(1,3-dimethyl-2,6-dioxopyrimidin-4-yl)carbamothioyl]benzamide has 2 hydrogen bond donor(s) and 4 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-chloro-N-[(1,3-dimethyl-2,6-dioxopyrimidin-4-yl)carbamothioyl]benzamide?
The CAS number of 4-chloro-N-[(1,3-dimethyl-2,6-dioxopyrimidin-4-yl)carbamothioyl]benzamide is 488732-85-0.
What is the molecular formula of 4-chloro-N-[(1,3-dimethyl-2,6-dioxopyrimidin-4-yl)carbamothioyl]benzamide?
The molecular formula of 4-chloro-N-[(1,3-dimethyl-2,6-dioxopyrimidin-4-yl)carbamothioyl]benzamide is C14H13ClN4O3S.
What is the molecular weight of 4-chloro-N-[(1,3-dimethyl-2,6-dioxopyrimidin-4-yl)carbamothioyl]benzamide?
The molecular weight of 4-chloro-N-[(1,3-dimethyl-2,6-dioxopyrimidin-4-yl)carbamothioyl]benzamide is 352.04 g/mol.
Where can I buy 4-chloro-N-[(1,3-dimethyl-2,6-dioxopyrimidin-4-yl)carbamothioyl]benzamide?
You can request a quote for 4-chloro-N-[(1,3-dimethyl-2,6-dioxopyrimidin-4-yl)carbamothioyl]benzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-chloro-N-[(1,3-dimethyl-2,6-dioxopyrimidin-4-yl)carbamothioyl]benzamide?
Yes, KEHONG BIO provides custom synthesis services for 4-chloro-N-[(1,3-dimethyl-2,6-dioxopyrimidin-4-yl)carbamothioyl]benzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.