TL;DR: [2-(4-methyl-3-morpholin-4-ylsulfonylanilino)-2-oxoethyl] 2-chloropyridine-3-carboxylate (CAS 389812-18-4) is a chemical compound with molecular formula C19H20ClN3O6S and molecular weight 453.07614 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[2-(4-methyl-3-morpholin-4-ylsulfonylanilino)-2-oxoethyl] 2-chloropyridine-3-carboxylate
Also Known As: [2-(4-methyl-3-morpholin-4-ylsulfonylanilino)-2-oxoethyl] 2-chloropyridine-3-carboxylate|(4-methyl-3-morpholin-4-ylsulfonyl-phenyl)carbamoylmethyl 2-chloropyridine-3-carboxylate|{[4-methyl-3-(morpholine-4-sulfonyl)phenyl]carbamoyl}methyl 2-chloropyridine-3-carboxylate|2-[4-Methyl-3-(morpholine-4-sulfonyl)anilino]-2-oxoethyl 2-chloropyridine-3-carboxylate|2-chloronicotinic acid [2-keto-2-(4-methyl-3-morpholinosulfonyl-anilino)ethyl] ester|[2-[(4-methyl-3-morpholin-4-ylsulfonyl-phenyl)amino]-2-oxidanylidene-ethyl] 2-chloranylpyridine-3-carboxylate|2-chloro-3-pyridinecarboxylic acid [2-[4-methyl-3-(4-morpholinylsulfonyl)anilino]-2-oxoethyl] ester|MLS002246363|SMR001309979|CHEMBL1990092|cid_4176313|EN300-26612074|Z19818750
| Molecular Formula | C19H20ClN3O6S |
| Molecular Weight | 453.07614 g/mol |
| XLogP | 1.7 |
| Topological Polar Surface Area (TPSA) | 123.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 7 |
| Exact Mass | 453.07614 Da |
| Heavy Atoms | 30 |
| Complexity | 710.0 |
| SMILES | CC1=C(C=C(C=C1)NC(=O)COC(=O)C2=C(N=CC=C2)Cl)S(=O)(=O)N3CCOCC3 |
| InChIKey | LVDSVSMCGLWHLA-UHFFFAOYSA-N |
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for [2-(4-methyl-3-morpholin-4-ylsulfonylanilino)-2-oxoethyl] 2-chloropyridine-3-carboxylate. The TPSA of 123.0 Ų falls within the moderate polarity range, balancing permeability and solubility for [2-(4-methyl-3-morpholin-4-ylsulfonylanilino)-2-oxoethyl] 2-chloropyridine-3-carboxylate. Following Lipinski's Rule of Five, [2-(4-methyl-3-morpholin-4-ylsulfonylanilino)-2-oxoethyl] 2-chloropyridine-3-carboxylate has 1 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of [2-(4-methyl-3-morpholin-4-ylsulfonylanilino)-2-oxoethyl] 2-chloropyridine-3-carboxylate is 389812-18-4.
The molecular formula of [2-(4-methyl-3-morpholin-4-ylsulfonylanilino)-2-oxoethyl] 2-chloropyridine-3-carboxylate is C19H20ClN3O6S.
The molecular weight of [2-(4-methyl-3-morpholin-4-ylsulfonylanilino)-2-oxoethyl] 2-chloropyridine-3-carboxylate is 453.07614 g/mol.
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