TL;DR: Urea, N-(5-chloro-1,2-dihydro-2-oxo-4-pyrimidinyl)-N'-methyl- (CAS 112878-98-5) is a chemical compound with molecular formula C6H7ClN4O2 and molecular weight 202.02576 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-(5-chloro-2-oxo-1H-pyrimidin-6-yl)-3-methylurea
Also Known As: Urea, N-(5-chloro-1,2-dihydro-2-oxo-4-pyrimidinyl)-N'-methyl-, 1-(5-chloro-2-oxo-1H-pyrimidin-6-yl)-3-methylurea, 1-(5-chloro-2-oxo-2,3-dihydropyrimidin-4-yl)-3-methylurea, N-(5-Chloro-2-oxo-2,3-dihydropyrimidin-4-yl)-N'-methylurea
| Molecular Formula | C6H7ClN4O2 |
| Molecular Weight | 202.02576 g/mol |
| XLogP | -0.7 |
| Topological Polar Surface Area (TPSA) | 82.6 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 202.02576 Da |
| Heavy Atoms | 13 |
| Complexity | 310.0 |
| SMILES | CNC(=O)NC1=C(C=NC(=O)N1)Cl |
| InChIKey | FFLOWLBFSLSMJL-UHFFFAOYSA-N |
The XLogP value of -0.7 indicates that Urea, N-(5-chloro-1,2-dihydro-2-oxo-4-pyrimidinyl)-N'-methyl- is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 82.6 Ų falls within the moderate polarity range, balancing permeability and solubility for Urea, N-(5-chloro-1,2-dihydro-2-oxo-4-pyrimidinyl)-N'-methyl-. Following Lipinski's Rule of Five, Urea, N-(5-chloro-1,2-dihydro-2-oxo-4-pyrimidinyl)-N'-methyl- has 3 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of Urea, N-(5-chloro-1,2-dihydro-2-oxo-4-pyrimidinyl)-N'-methyl- is 112878-98-5.
The molecular formula of Urea, N-(5-chloro-1,2-dihydro-2-oxo-4-pyrimidinyl)-N'-methyl- is C6H7ClN4O2.
The molecular weight of Urea, N-(5-chloro-1,2-dihydro-2-oxo-4-pyrimidinyl)-N'-methyl- is 202.02576 g/mol.
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