TL;DR: N,N-Diethyl-N'-(4-methyl-5H-dipyrido(4,3-b:3',4'-d) pyrrol-1-yl)-1,2-ethanediamine (CAS 109553-00-6) is a chemical compound with molecular formula C17H23N5 and molecular weight 297.19534 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N',N'-diethyl-N-(6-methyl-4,8,12-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaen-3-yl)ethane-1,2-diamine
Also Known As: N,N-Diethyl-N'-(4-methyl-5H-dipyrido(4,3-b:3',4'-d) pyrrol-1-yl)-1,2-ethanediamine, n,n-diethyl-n'-(4-methyl-5h-pyrrolo[3,2-c:4,5-c']dipyridin-1-yl)ethane-1,2-diamine, 1,2-Ethanediamine, N,N-diethyl-N-(4-methyl-5H-pyrrolo(3,2-c.4,5-c)dipyridin-1-yl)-, N,N-Diethyl-2-[(4-methyl-2,5-dihydro-1H-pyrrolo[3,2-c:4,5-c']dipyridin-1-ylidene)amino]ethan-1-amine
| Molecular Formula | C17H23N5 |
| Molecular Weight | 297.19534 g/mol |
| XLogP | 2.7 |
| Topological Polar Surface Area (TPSA) | 56.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 297.19534 Da |
| Heavy Atoms | 22 |
| Complexity | 346.0 |
| SMILES | CCN(CC)CCNC1=NC=C(C2=C1C3=C(N2)C=CN=C3)C |
| InChIKey | MQDCWBGBAPEDGF-UHFFFAOYSA-N |
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N,N-Diethyl-N'-(4-methyl-5H-dipyrido(4,3-b:3',4'-d) pyrrol-1-yl)-1,2-ethanediamine. With a topological polar surface area (TPSA) of 56.8 Ų, N,N-Diethyl-N'-(4-methyl-5H-dipyrido(4,3-b:3',4'-d) pyrrol-1-yl)-1,2-ethanediamine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N,N-Diethyl-N'-(4-methyl-5H-dipyrido(4,3-b:3',4'-d) pyrrol-1-yl)-1,2-ethanediamine has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of N,N-Diethyl-N'-(4-methyl-5H-dipyrido(4,3-b:3',4'-d) pyrrol-1-yl)-1,2-ethanediamine is 109553-00-6.
The molecular formula of N,N-Diethyl-N'-(4-methyl-5H-dipyrido(4,3-b:3',4'-d) pyrrol-1-yl)-1,2-ethanediamine is C17H23N5.
The molecular weight of N,N-Diethyl-N'-(4-methyl-5H-dipyrido(4,3-b:3',4'-d) pyrrol-1-yl)-1,2-ethanediamine is 297.19534 g/mol.
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