TL;DR: 4-(2-Hydroxy-3-(4-morpholino)propyl)-1H-pyrido(2,3-e)-1,4-diazepine-2,3,5(4H)-trione (CAS 101204-92-6) is a chemical compound with molecular formula C15H18N4O5 and molecular weight 334.12772 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-(2-hydroxy-3-morpholin-4-ylpropyl)-1H-pyrido[2,3-e][1,4]diazepine-2,3,5-trione
Also Known As: 4-(2-Hydroxy-3-(4-morpholino)propyl)-1H-pyrido(2,3-e)-1,4-diazepine-2,3,5(4H)-trione, 1H-Pyrido(2,3-e)-1,4-diazepine-2,3,5(4H)-trione, 4-(2-hydroxy-3-(4-morpholino)propyl)-, 4-(2-hydroxy-3-morpholin-4-ylpropyl)-1H-pyrido[2,3-e][1,4]diazepine-2,3,5-trione, 4-[2-Hydroxy-3-(morpholin-4-yl)propyl]-1H-pyrido[2,3-e][1,4]diazepine-2,3,5(4H)-trione
| Molecular Formula | C15H18N4O5 |
| Molecular Weight | 334.12772 g/mol |
| XLogP | -1.2 |
| Topological Polar Surface Area (TPSA) | 112.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 334.12772 Da |
| Heavy Atoms | 24 |
| Complexity | 508.0 |
| SMILES | C1COCCN1CC(CN2C(=O)C3=C(NC(=O)C2=O)N=CC=C3)O |
| InChIKey | LMRZSQNLGONTLH-UHFFFAOYSA-N |
The XLogP value of -1.2 indicates that 4-(2-Hydroxy-3-(4-morpholino)propyl)-1H-pyrido(2,3-e)-1,4-diazepine-2,3,5(4H)-trione is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 112.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-(2-Hydroxy-3-(4-morpholino)propyl)-1H-pyrido(2,3-e)-1,4-diazepine-2,3,5(4H)-trione. Following Lipinski's Rule of Five, 4-(2-Hydroxy-3-(4-morpholino)propyl)-1H-pyrido(2,3-e)-1,4-diazepine-2,3,5(4H)-trione has 2 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 4-(2-Hydroxy-3-(4-morpholino)propyl)-1H-pyrido(2,3-e)-1,4-diazepine-2,3,5(4H)-trione is 101204-92-6.
The molecular formula of 4-(2-Hydroxy-3-(4-morpholino)propyl)-1H-pyrido(2,3-e)-1,4-diazepine-2,3,5(4H)-trione is C15H18N4O5.
The molecular weight of 4-(2-Hydroxy-3-(4-morpholino)propyl)-1H-pyrido(2,3-e)-1,4-diazepine-2,3,5(4H)-trione is 334.12772 g/mol.
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