200,000+ products from a single source!
sales@angenechem.com
123875-01-4 | 3,5-Pyridinedicarboxylic acid, 1,4-dihydro-2,4,6-trimethyl-, 3-methyl 5-[2-(phenylthio)ethyl] ester
CAS No: 123875-01-4 Catalog No: AG000L7A MDL No:
Product Description
Catalog Number:
AG000L7A
Chemical Name:
3,5-Pyridinedicarboxylic acid, 1,4-dihydro-2,4,6-trimethyl-, 3-methyl 5-[2-(phenylthio)ethyl] ester
CAS Number:
123875-01-4
Molecular Formula:
C19H23NO4S
Molecular Weight:
361.4552
IUPAC Name:
3-O-methyl 5-O-(2-phenylsulfanylethyl) 2,4,6-trimethyl-1,4-dihydropyridine-3,5-dicarboxylate
InChI:
InChI=1S/C19H23NO4S/c1-12-16(18(21)23-4)13(2)20-14(3)17(12)19(22)24-10-11-25-15-8-6-5-7-9-15/h5-9,12,20H,10-11H2,1-4H3
InChI Key:
DHCNAWNKZMNTIS-UHFFFAOYSA-N
SMILES:
COC(=O)C1=C(C)NC(=C(C1C)C(=O)OCCSc1ccccc1)C
Properties
Complexity:
576
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
361.135g/mol
Formal Charge:
0
Heavy Atom Count:
25
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
361.456g/mol
Monoisotopic Mass:
361.135g/mol
Rotatable Bond Count:
8
Topological Polar Surface Area:
89.9A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
3.6
Literature
| Title | Journal |
|---|---|
| Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis. | Bioorganic & medicinal chemistry letters 20101101 |
| Platelet-activating factor receptor plays a role in lung injury and death caused by Influenza A in mice. | PLoS pathogens 20101101 |
| Fat10 is an epigenetic marker for liver preneoplasia in a drug-primed mouse model of tumorigenesis. | Experimental and molecular pathology 20080401 |
| Neutrophil migration in mice induced by a mannose-binding lectin isolated from Annona coriacea seeds. | Toxicon : official journal of the International Society on Toxinology 20061001 |
| A role for inflammatory mediators in the induction of immunoregulatory B cells. | Journal of immunology (Baltimore, Md. : 1950) 20061001 |
| Microglial calcium responses to platelet-activating factor are inhibited by analogue CAS 99103-16-9 and dihydropyridine PCA 4248 but not by ginkgolide A. | Basic & clinical pharmacology & toxicology 20040801 |
| Platelet activating factor receptor binding plays a critical role in jet fuel-induced immune suppression. | Toxicology and applied pharmacology 20040315 |
| Pharmacological actions of PCA 4248, a new platelet-activating factor receptor antagonist: in vivo studies. | The Journal of pharmacology and experimental therapeutics 19901001 |
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.