TL;DR: 3-(4-Methylphenyl)iminoisoindol-1-amine (CAS 104830-21-9) is a chemical compound with molecular formula C15H13N3 and molecular weight 235.11095 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-(4-methylphenyl)iminoisoindol-1-amine
Also Known As: 3-(4-methylphenyl)iminoisoindol-1-amine, 1H-Isoindol-3-amine,1-imino-N-(4-methylphenyl)-, 3-amino-1-(4-methylphenyl)imino-1h-isoindole, (1Z)-1-[(4-METHYLPHENYL)IMINO]-1H-ISOINDOL-3-AMINE, AP-906/14180855
| Molecular Formula | C15H13N3 |
| Molecular Weight | 235.11095 g/mol |
| XLogP | 2.6 |
| Topological Polar Surface Area (TPSA) | 50.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 235.11095 Da |
| Heavy Atoms | 18 |
| Complexity | 364.0 |
| SMILES | CC1=CC=C(C=C1)N=C2C3=CC=CC=C3C(=N2)N |
| InChIKey | CYUAYNFKQWLQDD-UHFFFAOYSA-N |
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(4-Methylphenyl)iminoisoindol-1-amine. With a topological polar surface area (TPSA) of 50.7 Ų, 3-(4-Methylphenyl)iminoisoindol-1-amine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(4-Methylphenyl)iminoisoindol-1-amine has 1 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 3-(4-Methylphenyl)iminoisoindol-1-amine is 104830-21-9.
The molecular formula of 3-(4-Methylphenyl)iminoisoindol-1-amine is C15H13N3.
The molecular weight of 3-(4-Methylphenyl)iminoisoindol-1-amine is 235.11095 g/mol.
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