TL;DR: 2,4-Dimethyl-5,11-dihydro-6H-pyrido(2,3-b)(1,4)benzodiazepin-6-one (CAS 114368-13-7) is a chemical compound with molecular formula C14H13N3O and molecular weight 239.10587 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2,4-dimethyl-5,11-dihydropyrido[2,3-b][1,4]benzodiazepin-6-one
Also Known As: BI-RG-587 analog, 2,4-Dimethyl-5,11-dihydro-6H-pyrido(2,3-b)(1,4)benzodiazepin-6-one, 2,4-dimethyl-5,11-dihydropyrido[2,3-b][1,4]benzodiazepin-6-one, 2,4-Dimethyl-5,11-dihydro-6H-pyrido[2,3-b][1,4]benzodiazepin-6-one, 6H-Pyrido[2,3-b][1,4]benzodiazepin-6-one,5,11-dihydro-2,4-dimethyl-
Top 5 of 2 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C14H13N3O |
| Molecular Weight | 239.10587 g/mol |
| XLogP | 2.4 |
| Topological Polar Surface Area (TPSA) | 54.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 239.10587 Da |
| Heavy Atoms | 18 |
| Complexity | 333.0 |
| SMILES | CC1=CC(=NC2=C1NC(=O)C3=CC=CC=C3N2)C |
| InChIKey | NEJSZRPFHKBQHV-UHFFFAOYSA-N |
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,4-Dimethyl-5,11-dihydro-6H-pyrido(2,3-b)(1,4)benzodiazepin-6-one. With a topological polar surface area (TPSA) of 54.0 Ų, 2,4-Dimethyl-5,11-dihydro-6H-pyrido(2,3-b)(1,4)benzodiazepin-6-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,4-Dimethyl-5,11-dihydro-6H-pyrido(2,3-b)(1,4)benzodiazepin-6-one has 2 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 2,4-Dimethyl-5,11-dihydro-6H-pyrido(2,3-b)(1,4)benzodiazepin-6-one is 114368-13-7.
The molecular formula of 2,4-Dimethyl-5,11-dihydro-6H-pyrido(2,3-b)(1,4)benzodiazepin-6-one is C14H13N3O.
The molecular weight of 2,4-Dimethyl-5,11-dihydro-6H-pyrido(2,3-b)(1,4)benzodiazepin-6-one is 239.10587 g/mol.
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