TL;DR: L 738872 (CAS 159565-70-5) is a chemical compound with molecular formula C34H50ClN5O6S and molecular weight 691.317 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[(2R,3R)-1,1-dioxo-2-propan-2-ylthiolan-3-yl] N-[(2S,3R)-4-[(2S)-2-(tert-butylcarbamoyl)-4-[(2-chloro-6-methyl-4-pyridinyl)methyl]piperazin-1-yl]-3-hydroxy-1-phenylbutan-2-yl]carbamate
Also Known As: L 738872, L-738,872, [(2R,3R)-1,1-dioxo-2-propan-2-ylthiolan-3-yl] N-[(2S,3R)-4-[(2S)-2-(tert-butylcarbamoyl)-4-[(2-chloro-6-methylpyridin-4-yl)methyl]piperazin-1-yl]-3-hydroxy-1-phenylbutan-2-yl]carbamate, L-738872, Carbamic acid, (3-(4-((2-chloro-6-methyl-4-pyridinyl)methyl)-2-(((1,1-dimethylethyl)amino)carbonyl)-1-piperazinyl)-2-hydroxy-1-(phenylmethyl)propyl)-, tetrahydro-2-(1-methylethyl)-1,1-dioxido-3-thienyl ester, (2R-(2alpha,3alpha(1S*,2R*,3(S*))))-
| Molecular Formula | C34H50ClN5O6S |
| Molecular Weight | 691.317 g/mol |
| XLogP | 4.3 |
| Topological Polar Surface Area (TPSA) | 150.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 13 |
| Exact Mass | 691.317 Da |
| Heavy Atoms | 47 |
| Complexity | 1140.0 |
| SMILES | CC1=CC(=CC(=N1)Cl)CN2CCN([C@@H](C2)C(=O)NC(C)(C)C)C[C@H]([C@H](CC3=CC=CC=C3)NC(=O)O[C@@H]4CCS(=O)(=O)[C@@H]4C(C)C)O |
| InChIKey | VSPVBJSAOGVXFP-STSTVOBVSA-N |
The XLogP value of 4.3 indicates that L 738872 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 150.0 Ų indicates high polarity, suggesting L 738872 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, L 738872 has 3 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of L 738872 is 159565-70-5.
The molecular formula of L 738872 is C34H50ClN5O6S.
The molecular weight of L 738872 is 691.317 g/mol.
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