Bis(4-hydroxy-2-methyl-2,3-dihydro-1H-1,5-benzodiazepin-1-yl)ethane-1,2-dione
TL;DR: Bis(4-hydroxy-2-methyl-2,3-dihydro-1H-1,5-benzodiazepin-1-yl)ethane-1,2-dione (CAS 144401-04-7) is a chemical compound with molecular formula C22H22N4O4 and molecular weight 406.1641 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1,2-bis(4-methyl-2-oxo-3,4-dihydro-1H-1,5-benzodiazepin-5-yl)ethane-1,2-dione
Also Known As: 1,2-bis ethane-1,2-dione, 5,5'-(1,2-Dioxo-1,2-ethanediyl)bis(1,3,4,5-tetrahydro-4-methyl-2H-1,5-benzodiazepin-2-one), 2H-1,5-Benzodiazepin-2-one, 5,5'-(1,2-dioxo-1,2-ethanediyl)bis(1,3,4,5-tetrahydro-4-methyl-, 1,2-bis(4-methyl-2-oxo-3,4-dihydro-1H-1,5-benzodiazepin-5-yl)ethane-1,2-dione, 1,2-bis(3-methyl-5-oxo-2,6-diazabicyclo[5.4.0]undeca-7,9,11-trien-2-yl )ethane-1,2-dione
Technical Specifications
| Molecular Formula | C22H22N4O4 |
| Molecular Weight | 406.1641 g/mol |
| XLogP | 1.4 |
| Topological Polar Surface Area (TPSA) | 98.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 0 |
| Exact Mass | 406.1641 Da |
| Heavy Atoms | 30 |
| Complexity | 666.0 |
| SMILES | CC1CC(=O)NC2=CC=CC=C2N1C(=O)C(=O)N3C(CC(=O)NC4=CC=CC=C43)C |
| InChIKey | OHQOVEOWZFHUTR-UHFFFAOYSA-N |
Chemical Property Profile of Bis(4-hydroxy-2-methyl-2,3-dihydro-1H-1,5-benzodiazepin-1-yl)ethane-1,2-dione
Property Insights of Bis(4-hydroxy-2-methyl-2,3-dihydro-1H-1,5-benzodiazepin-1-yl)ethane-1,2-dione
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Bis(4-hydroxy-2-methyl-2,3-dihydro-1H-1,5-benzodiazepin-1-yl)ethane-1,2-dione. The TPSA of 98.8 Ų falls within the moderate polarity range, balancing permeability and solubility for Bis(4-hydroxy-2-methyl-2,3-dihydro-1H-1,5-benzodiazepin-1-yl)ethane-1,2-dione. Following Lipinski's Rule of Five, Bis(4-hydroxy-2-methyl-2,3-dihydro-1H-1,5-benzodiazepin-1-yl)ethane-1,2-dione has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Bis(4-hydroxy-2-methyl-2,3-dihydro-1H-1,5-benzodiazepin-1-yl)ethane-1,2-dione?
The CAS number of Bis(4-hydroxy-2-methyl-2,3-dihydro-1H-1,5-benzodiazepin-1-yl)ethane-1,2-dione is 144401-04-7.
What is the molecular formula of Bis(4-hydroxy-2-methyl-2,3-dihydro-1H-1,5-benzodiazepin-1-yl)ethane-1,2-dione?
The molecular formula of Bis(4-hydroxy-2-methyl-2,3-dihydro-1H-1,5-benzodiazepin-1-yl)ethane-1,2-dione is C22H22N4O4.
What is the molecular weight of Bis(4-hydroxy-2-methyl-2,3-dihydro-1H-1,5-benzodiazepin-1-yl)ethane-1,2-dione?
The molecular weight of Bis(4-hydroxy-2-methyl-2,3-dihydro-1H-1,5-benzodiazepin-1-yl)ethane-1,2-dione is 406.1641 g/mol.
Where can I buy Bis(4-hydroxy-2-methyl-2,3-dihydro-1H-1,5-benzodiazepin-1-yl)ethane-1,2-dione?
You can request a quote for Bis(4-hydroxy-2-methyl-2,3-dihydro-1H-1,5-benzodiazepin-1-yl)ethane-1,2-dione directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Bis(4-hydroxy-2-methyl-2,3-dihydro-1H-1,5-benzodiazepin-1-yl)ethane-1,2-dione?
Yes, CoreyChem provides custom synthesis services for Bis(4-hydroxy-2-methyl-2,3-dihydro-1H-1,5-benzodiazepin-1-yl)ethane-1,2-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.