TL;DR: LY-272015 free base (CAS 159730-07-1) is a chemical compound with molecular formula C21H24N2O2 and molecular weight 336.18378 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-[(3,4-dimethoxyphenyl)methyl]-6-methyl-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole
Also Known As: LY-272015 free base, LY 272015 HYDROCHLORIDE, LY-272,015, 1-[(3,4-Dimethoxyphenyl)methyl]-2,3,4,9-tetrahydro-6-methyl-1H-pyrido[3,4-b]indole, 1-(3,4-Dimethoxy-benzyl)-6-methyl-2,3,4,9-tetrahydro-1H-beta-carboline
| Molecular Formula | C21H24N2O2 |
| Molecular Weight | 336.18378 g/mol |
| XLogP | 3.8 |
| Topological Polar Surface Area (TPSA) | 46.3 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 336.18378 Da |
| Heavy Atoms | 25 |
| Complexity | 446.0 |
| SMILES | CC1=CC2=C(C=C1)NC3=C2CCNC3CC4=CC(=C(C=C4)OC)OC |
| InChIKey | GDAJGLDMCDMPIR-UHFFFAOYSA-N |
The XLogP value of 3.8 indicates that LY-272015 free base is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 46.3 Ų, LY-272015 free base exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, LY-272015 free base has 2 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of LY-272015 free base is 159730-07-1.
The molecular formula of LY-272015 free base is C21H24N2O2.
The molecular weight of LY-272015 free base is 336.18378 g/mol.
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