TL;DR: Deambp (CAS 115750-59-9) is a chemical compound with molecular formula C20H27N3O2 and molecular weight 341.21033 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N',N'-diethyl-N-(9-methoxy-5,11-dihydro-[1]benzoxepino[3,4-b]pyridin-11-yl)ethane-1,2-diamine
Also Known As: Deambp, KW-3407 Free, KW 3407, 5-((2-(Diethylamino)ethyl)amino)-7-methoxy-5,11-dihydro(1)benzoxepino(3,4-b)pyridine, N',N'-diethyl-N-(9-methoxy-5,11-dihydro-[1]benzoxepino[3,4-b]pyridin-11-yl)ethane-1,2-diamine
| Molecular Formula | C20H27N3O2 |
| Molecular Weight | 341.21033 g/mol |
| XLogP | 2.2 |
| Topological Polar Surface Area (TPSA) | 46.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 341.21033 Da |
| Heavy Atoms | 25 |
| Complexity | 391.0 |
| SMILES | CCN(CC)CCNC1C2=C(COC3=C1C=C(C=C3)OC)N=CC=C2 |
| InChIKey | LHJPLYUWEHXOOU-UHFFFAOYSA-N |
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Deambp. With a topological polar surface area (TPSA) of 46.6 Ų, Deambp exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Deambp has 1 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 Deambp is 115750-59-9.
The molecular formula of Deambp is C20H27N3O2.
The molecular weight of Deambp is 341.21033 g/mol.
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