TL;DR: LG 83-6-05 (CAS 131602-70-5) is a chemical compound with molecular formula C21H29NO3S and molecular weight 375.18683 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-[3-[2-hydroxy-3-(2-methylpropylamino)propoxy]-4-methylthiophen-2-yl]-3-phenylpropan-1-one
Also Known As: LG 83-6-05, 1-(3-(2-Hydroxy-3-(2-methylpropylamino)propoxy)-4-methyl-2-thienyl)-3-phenyl-1-propanone, O-[3-(3-aminopropylamino)propyl]hydroxylamine, 1-[3-[2-hydroxy-3-(2-methylpropylamino)propoxy]-4-methylthiophen-2-yl]-3-phenylpropan-1-one, 1-(3-(2-hydroxy-3-(isobutylamino)propoxy)-4-methylthiophen-2-yl)-3-phenylpropan-1-one
Top 5 of 3 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C21H29NO3S |
| Molecular Weight | 375.18683 g/mol |
| XLogP | 4.1 |
| Topological Polar Surface Area (TPSA) | 86.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 11 |
| Exact Mass | 375.18683 Da |
| Heavy Atoms | 26 |
| Complexity | 412.0 |
| SMILES | CC1=CSC(=C1OCC(CNCC(C)C)O)C(=O)CCC2=CC=CC=C2 |
| InChIKey | YDXYOAAMYRVKSZ-UHFFFAOYSA-N |
The XLogP value of 4.1 indicates that LG 83-6-05 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 86.8 Ų falls within the moderate polarity range, balancing permeability and solubility for LG 83-6-05. Following Lipinski's Rule of Five, LG 83-6-05 has 2 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of LG 83-6-05 is 131602-70-5.
The molecular formula of LG 83-6-05 is C21H29NO3S.
The molecular weight of LG 83-6-05 is 375.18683 g/mol.
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