TL;DR: Pyrido[1,2-b][2,4]benzodiazepin-6(11H)-imine (CAS 113918-51-7) is a chemical compound with molecular formula C13H11N3 and molecular weight 209.09529 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
11H-pyrido[1,2-b][2,4]benzodiazepin-6-imine
Also Known As: Pyrido[1,2-b][2,4]benzodiazepin-6(11H)-imine, 11H-pyrido[1,2-b][2,4]benzodiazepin-6-imine, Benzo[e]pyrido[1,2-a][1,3]diazepin-6(11H)-imine, pyrido[1,2-b][2,4]benzodiazepin-6(11H)-imine hydrobromide, AH-034/11365949
| Molecular Formula | C13H11N3 |
| Molecular Weight | 209.09529 g/mol |
| XLogP | 1.6 |
| Topological Polar Surface Area (TPSA) | 39.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 209.09529 Da |
| Heavy Atoms | 16 |
| Complexity | 392.0 |
| SMILES | C1C2=CC=CC=C2C(=N)N=C3N1C=CC=C3 |
| InChIKey | ZPDCPCGOMKZJCQ-UHFFFAOYSA-N |
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Pyrido[1,2-b][2,4]benzodiazepin-6(11H)-imine. With a topological polar surface area (TPSA) of 39.5 Ų, Pyrido[1,2-b][2,4]benzodiazepin-6(11H)-imine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Pyrido[1,2-b][2,4]benzodiazepin-6(11H)-imine 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 Pyrido[1,2-b][2,4]benzodiazepin-6(11H)-imine is 113918-51-7.
The molecular formula of Pyrido[1,2-b][2,4]benzodiazepin-6(11H)-imine is C13H11N3.
The molecular weight of Pyrido[1,2-b][2,4]benzodiazepin-6(11H)-imine is 209.09529 g/mol.
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