TL;DR: N11-Ethyl-8,N6-dimethyl-6,11-dihydro-5H-pyrido(2,3-b)(1,5)benzodiazepin-5-one (CAS 133626-68-3) is a chemical compound with molecular formula C16H17N3O and molecular weight 267.13718 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
11-ethyl-6,8-dimethylpyrido[3,2-c][1,5]benzodiazepin-5-one
Also Known As: BI-RG-587 analog, Pyridobenzodiazepinone deriv. 34, N11-Ethyl-8,N6-dimethyl-6,11-dihydro-5H-pyrido(2,3-b)(1,5)benzodiazepin-5-one, 11-ethyl-6,8-dimethyl-pyrido[3,2-c][1,5]benzodiazepin-5-one, 11-ethyl-6,8-dimethylpyrido[3,2-c][1,5]benzodiazepin-5-one
| Molecular Formula | C16H17N3O |
| Molecular Weight | 267.13718 g/mol |
| XLogP | 2.7 |
| Topological Polar Surface Area (TPSA) | 36.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 267.13718 Da |
| Heavy Atoms | 20 |
| Complexity | 373.0 |
| SMILES | CCN1C2=C(C=C(C=C2)C)N(C(=O)C3=C1N=CC=C3)C |
| InChIKey | FIGRBQAMMXFIMA-UHFFFAOYSA-N |
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N11-Ethyl-8,N6-dimethyl-6,11-dihydro-5H-pyrido(2,3-b)(1,5)benzodiazepin-5-one. With a topological polar surface area (TPSA) of 36.4 Ų, N11-Ethyl-8,N6-dimethyl-6,11-dihydro-5H-pyrido(2,3-b)(1,5)benzodiazepin-5-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N11-Ethyl-8,N6-dimethyl-6,11-dihydro-5H-pyrido(2,3-b)(1,5)benzodiazepin-5-one has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of N11-Ethyl-8,N6-dimethyl-6,11-dihydro-5H-pyrido(2,3-b)(1,5)benzodiazepin-5-one is 133626-68-3.
The molecular formula of N11-Ethyl-8,N6-dimethyl-6,11-dihydro-5H-pyrido(2,3-b)(1,5)benzodiazepin-5-one is C16H17N3O.
The molecular weight of N11-Ethyl-8,N6-dimethyl-6,11-dihydro-5H-pyrido(2,3-b)(1,5)benzodiazepin-5-one is 267.13718 g/mol.
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