TL;DR: Sch 434 (CAS 132316-36-0) is a chemical compound with molecular formula C32H38ClN3O3 and molecular weight 547.2602 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
ethyl 4-(13-chloro-4-azatricyclo[9.4.0.03,8]pentadeca-1(11),3(8),4,6,12,14-hexaen-2-ylidene)piperidine-1-carboxylate;(1S,2S)-2-(methylamino)-1-phenylpropan-1-ol
Also Known As: Sch 434, Loratadine/pseudoephedrine, Loratadine / pseudoephedrine, Loratadine mixture with pseudoephedrine, 1-Piperidinecarboxylic acid, 4-(8-chloro-5,6-dihydro-11H-benzo(5,6)cyclohepta(1,2-b)pyridin-11-ylidene)-, ethyl ester, mixt. with (S-(R*,R*))-alpha-(1-(methylamino)ethyl)benzenemethanol
| Molecular Formula | C32H38ClN3O3 |
| Molecular Weight | 547.2602 g/mol |
| XLogP | 6.2157 |
| Topological Polar Surface Area (TPSA) | 74.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 547.2602 Da |
| Heavy Atoms | 39 |
| Complexity | 690.0 |
| SMILES | CCOC(=O)N1CCC(=C2C3=C(CCC4=C2N=CC=C4)C=C(C=C3)Cl)CC1.C[C@@H]([C@H](C1=CC=CC=C1)O)NC |
| InChIKey | ZQBWEJQBVWJHRY-PXRPMCEGSA-N |
The XLogP value of 6.2157 indicates that Sch 434 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 74.7 Ų falls within the moderate polarity range, balancing permeability and solubility for Sch 434. Following Lipinski's Rule of Five, Sch 434 has 2 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of Sch 434 is 132316-36-0.
The molecular formula of Sch 434 is C32H38ClN3O3.
The molecular weight of Sch 434 is 547.2602 g/mol.
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