TL;DR: Isopropylpropenylbarbitursaure (CAS 67051-43-8) is a chemical compound with molecular formula C10H14N2O3 and molecular weight 210.10045 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
5-propan-2-yl-5-prop-1-enyl-1,3-diazinane-2,4,6-trione
Also Known As: Isopropylpropenylbarbitursaure, 5-propan-2-yl-5-prop-1-enyl-1,3-diazinane-2,4,6-trione, 5-propan-2-yl-5-[(E)-prop-1-enyl]-1,3-diazinane-2,4,6-trione
Top 5 of 1 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C10H14N2O3 |
| Molecular Weight | 210.10045 g/mol |
| XLogP | 1.0 |
| Topological Polar Surface Area (TPSA) | 75.3 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 210.10045 Da |
| Heavy Atoms | 15 |
| Complexity | 325.0 |
| SMILES | CC=CC1(C(=O)NC(=O)NC1=O)C(C)C |
| InChIKey | RJJSCIXMNXYONU-UHFFFAOYSA-N |
The XLogP value of 1.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Isopropylpropenylbarbitursaure. The TPSA of 75.3 Ų falls within the moderate polarity range, balancing permeability and solubility for Isopropylpropenylbarbitursaure. Following Lipinski's Rule of Five, Isopropylpropenylbarbitursaure 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 Isopropylpropenylbarbitursaure is 67051-43-8.
The molecular formula of Isopropylpropenylbarbitursaure is C10H14N2O3.
The molecular weight of Isopropylpropenylbarbitursaure is 210.10045 g/mol.
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