5-Pyrimidinecarboxanilide, 1,2,3,4,5,6-hexahydro-4'-chloro-2,4,6-trioxothio-
TL;DR: 5-Pyrimidinecarboxanilide, 1,2,3,4,5,6-hexahydro-4'-chloro-2,4,6-trioxothio- (CAS 7626-13-3) is a chemical compound with molecular formula C11H8ClN3O3S and molecular weight 297.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(4-chlorophenyl)-2,4,6-trioxo-1,3-diazinane-5-carbothioamide
Also Known As: 5-p-Chlorofenylokarbamoilobarbiturowy, 5-p-Chlorofenylokarbamoilobarbiturowy [Polish], 5-Pyrimidinecarboxanilide, 1,2,3,4,5,6-hexahydro-4'-chloro-2,4,6-trioxothio-, 1,2,3,4,5,6-Hexahydro-4'-chloro-2,4,6-trioxothio-5-pyrimidinecarboxanilide, N-(4-chlorophenyl)-2,4,6-trioxo-1,3-diazinane-5-carbothioamide
| Molecular Formula | C11H8ClN3O3S |
|---|---|
| Molecular Weight | 297.00 g/mol |
| LogP | 1.0615 |
| Topological Polar Surface Area | 87.3 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 296.9975 |
| Heavy Atoms | 19 |
| Complexity | 553.0531 |
Chemical Identifiers
| CAS Number | 7626-13-3 |
|---|---|
| SMILES | C1=CC(=CC=C1NC(=S)C2C(=O)NC(=O)NC2=O)Cl |
Product Overview
5-Pyrimidinecarboxanilide, 1,2,3,4,5,6-hexahydro-4'-chloro-2,4,6-trioxothio- (CAS 7626-13-3), with molecular formula C11H8ClN3O3S and molecular weight 297.00 g/mol. IUPAC: N-(4-chlorophenyl)-2,4,6-trioxo-1,3-diazinane-5-carbothioamide.
Chemical Property Profile of 5-Pyrimidinecarboxanilide, 1,2,3,4,5,6-hexahydro-4'-chloro-2,4,6-trioxothio-
Property Insights of 5-Pyrimidinecarboxanilide, 1,2,3,4,5,6-hexahydro-4'-chloro-2,4,6-trioxothio-
The XLogP value of 1.0615 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-Pyrimidinecarboxanilide, 1,2,3,4,5,6-hexahydro-4'-chloro-2,4,6-trioxothio-. The TPSA of 87.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-Pyrimidinecarboxanilide, 1,2,3,4,5,6-hexahydro-4'-chloro-2,4,6-trioxothio-. Following Lipinski's Rule of Five, 5-Pyrimidinecarboxanilide, 1,2,3,4,5,6-hexahydro-4'-chloro-2,4,6-trioxothio- has 3 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 5-Pyrimidinecarboxanilide, 1,2,3,4,5,6-hexahydro-4'-chloro-2,4,6-trioxothio-?
The CAS number of 5-Pyrimidinecarboxanilide, 1,2,3,4,5,6-hexahydro-4'-chloro-2,4,6-trioxothio- is 7626-13-3.
What is the molecular formula of 5-Pyrimidinecarboxanilide, 1,2,3,4,5,6-hexahydro-4'-chloro-2,4,6-trioxothio-?
The molecular formula of 5-Pyrimidinecarboxanilide, 1,2,3,4,5,6-hexahydro-4'-chloro-2,4,6-trioxothio- is C11H8ClN3O3S.
What is the molecular weight of 5-Pyrimidinecarboxanilide, 1,2,3,4,5,6-hexahydro-4'-chloro-2,4,6-trioxothio-?
The molecular weight of 5-Pyrimidinecarboxanilide, 1,2,3,4,5,6-hexahydro-4'-chloro-2,4,6-trioxothio- is 297.00 g/mol.
Where can I buy 5-Pyrimidinecarboxanilide, 1,2,3,4,5,6-hexahydro-4'-chloro-2,4,6-trioxothio-?
You can request a quote for 5-Pyrimidinecarboxanilide, 1,2,3,4,5,6-hexahydro-4'-chloro-2,4,6-trioxothio- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-Pyrimidinecarboxanilide, 1,2,3,4,5,6-hexahydro-4'-chloro-2,4,6-trioxothio-?
Yes, KEHONG BIO provides custom synthesis services for 5-Pyrimidinecarboxanilide, 1,2,3,4,5,6-hexahydro-4'-chloro-2,4,6-trioxothio- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.