TL;DR: CTK4C3127 (CAS 142469-88-3) is a chemical compound with molecular formula C20H30N2O5 and molecular weight 378.21548 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
but-2-enedioic acid;3-methoxy-N-methyl-N-[(1-phenylpyrrolidin-2-yl)methyl]propan-1-amine
Also Known As: (-)-N-(3-METHOXYPROPYL)-N-METHYL-1-PHENYL-2-PYRROLIDINEMETHANAMINE FUM ARATE, (-)-N-(3-Methoxypropyl)-N-methyl-1-phenyl-2-pyrrolidinemethanamine fumarate, 2-Pyrrolidinemethanamine, N-(3-methoxypropyl)-N-methyl-1-phenyl-, (-)-, (E)-2-butenedioate (1:1)
| Molecular Formula | C20H30N2O5 |
| Molecular Weight | 378.21548 g/mol |
| XLogP | 2.3355 |
| Topological Polar Surface Area (TPSA) | 90.3 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 9 |
| Exact Mass | 378.21548 Da |
| Heavy Atoms | 27 |
| Complexity | 360.0 |
| SMILES | CN(CCCOC)CC1CCCN1C2=CC=CC=C2.C(=CC(=O)O)C(=O)O |
| InChIKey | FAWVQHAGGIVZMF-UHFFFAOYSA-N |
The XLogP value of 2.3355 suggests moderate lipophilicity, balancing water solubility and membrane permeability for CTK4C3127. The TPSA of 90.3 Ų falls within the moderate polarity range, balancing permeability and solubility for CTK4C3127. Following Lipinski's Rule of Five, CTK4C3127 has 2 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of CTK4C3127 is 142469-88-3.
The molecular formula of CTK4C3127 is C20H30N2O5.
The molecular weight of CTK4C3127 is 378.21548 g/mol.
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