Benzoic acid, 3-chloro-2-((4,6-dimethoxy-2-pyrimidinyl)thio)-6-methoxy-
TL;DR: Benzoic acid, 3-chloro-2-((4,6-dimethoxy-2-pyrimidinyl)thio)-6-methoxy- (CAS 143437-11-0) is a chemical compound with molecular formula C14H13ClN2O5S and molecular weight 356.02338 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-chloro-2-(4,6-dimethoxypyrimidin-2-yl)sulfanyl-6-methoxybenzoic acid
Also Known As: Benzoic acid, 3-chloro-2-((4,6-dimethoxy-2-pyrimidinyl)thio)-6-methoxy-, 3-Chloro-2-((4,6-dimethoxy-2-pyrimidinyl)thio)-6-methoxybenzoic acid, 3-chloro-2-(4,6-dimethoxypyrimidin-2-yl)sulfanyl-6-methoxybenzoic acid, 3-CHLORO-2-[(4,6-DIMETHOXYPYRIMIDIN-2-YL)SULFANYL]-6-METHOXYBENZOIC ACID
Technical Specifications
| Molecular Formula | C14H13ClN2O5S |
| Molecular Weight | 356.02338 g/mol |
| XLogP | 3.3 |
| Topological Polar Surface Area (TPSA) | 116.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 6 |
| Exact Mass | 356.02338 Da |
| Heavy Atoms | 23 |
| Complexity | 393.0 |
| SMILES | COC1=C(C(=C(C=C1)Cl)SC2=NC(=CC(=N2)OC)OC)C(=O)O |
| InChIKey | IUYDJCYJSRHIOV-UHFFFAOYSA-N |
Chemical Property Profile of Benzoic acid, 3-chloro-2-((4,6-dimethoxy-2-pyrimidinyl)thio)-6-methoxy-
Property Insights of Benzoic acid, 3-chloro-2-((4,6-dimethoxy-2-pyrimidinyl)thio)-6-methoxy-
The XLogP value of 3.3 indicates that Benzoic acid, 3-chloro-2-((4,6-dimethoxy-2-pyrimidinyl)thio)-6-methoxy- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 116.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Benzoic acid, 3-chloro-2-((4,6-dimethoxy-2-pyrimidinyl)thio)-6-methoxy-. Following Lipinski's Rule of Five, Benzoic acid, 3-chloro-2-((4,6-dimethoxy-2-pyrimidinyl)thio)-6-methoxy- has 1 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Benzoic acid, 3-chloro-2-((4,6-dimethoxy-2-pyrimidinyl)thio)-6-methoxy-?
The CAS number of Benzoic acid, 3-chloro-2-((4,6-dimethoxy-2-pyrimidinyl)thio)-6-methoxy- is 143437-11-0.
What is the molecular formula of Benzoic acid, 3-chloro-2-((4,6-dimethoxy-2-pyrimidinyl)thio)-6-methoxy-?
The molecular formula of Benzoic acid, 3-chloro-2-((4,6-dimethoxy-2-pyrimidinyl)thio)-6-methoxy- is C14H13ClN2O5S.
What is the molecular weight of Benzoic acid, 3-chloro-2-((4,6-dimethoxy-2-pyrimidinyl)thio)-6-methoxy-?
The molecular weight of Benzoic acid, 3-chloro-2-((4,6-dimethoxy-2-pyrimidinyl)thio)-6-methoxy- is 356.02338 g/mol.
Where can I buy Benzoic acid, 3-chloro-2-((4,6-dimethoxy-2-pyrimidinyl)thio)-6-methoxy-?
You can request a quote for Benzoic acid, 3-chloro-2-((4,6-dimethoxy-2-pyrimidinyl)thio)-6-methoxy- directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Benzoic acid, 3-chloro-2-((4,6-dimethoxy-2-pyrimidinyl)thio)-6-methoxy-?
Yes, CoreyChem provides custom synthesis services for Benzoic acid, 3-chloro-2-((4,6-dimethoxy-2-pyrimidinyl)thio)-6-methoxy- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.