TL;DR: SBE13 (CAS 1052532-15-6) is a chemical compound with molecular formula C24H27ClN2O4 and molecular weight 442.16592 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-[[4-[(6-chloro-3-pyridinyl)methoxy]-3-methoxyphenyl]methyl]-2-(3,4-dimethoxyphenyl)ethanamine
Also Known As: SBE13, SBE 13, SBE13?, 3475AH, AP-970/42896634
| Molecular Formula | C24H27ClN2O4 |
| Molecular Weight | 442.16592 g/mol |
| XLogP | 4.5 |
| Topological Polar Surface Area (TPSA) | 61.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 11 |
| Exact Mass | 442.16592 Da |
| Heavy Atoms | 31 |
| Complexity | 500.0 |
| SMILES | COC1=C(C=C(C=C1)CCNCC2=CC(=C(C=C2)OCC3=CN=C(C=C3)Cl)OC)OC |
| InChIKey | XNPRQBVQOJZMMA-UHFFFAOYSA-N |
The XLogP value of 4.5 indicates that SBE13 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 61.8 Ų falls within the moderate polarity range, balancing permeability and solubility for SBE13. Following Lipinski's Rule of Five, SBE13 has 1 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of SBE13 is 1052532-15-6.
The molecular formula of SBE13 is C24H27ClN2O4.
The molecular weight of SBE13 is 442.16592 g/mol.
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