4-(2-chlorophenyl)-6-methyl-5-nitro-3,4-dihydro-1H-pyrimidin-2-one
TL;DR: 4-(2-chlorophenyl)-6-methyl-5-nitro-3,4-dihydro-1H-pyrimidin-2-one (CAS 159587-37-8) is a chemical compound with molecular formula C11H10ClN3O3 and molecular weight 267.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(2-chlorophenyl)-6-methyl-5-nitro-3,4-dihydro-1H-pyrimidin-2-one
Also Known As: BAS 00086982, 4-(2-chlorophenyl)-6-methyl-5-nitro-3,4-dihydro-1H-pyrimidin-2-one, 4-(2-Chloro-phenyl)-6-methyl-5-nitro-3,4-dihydro-1H-pyrimidin-2-one, 6-(2-chlorophenyl)-4-methyl-5-nitro-1,3,6-trihydropyrimidin-2-one, 6-(2-chlorophenyl)-4-methyl-5-nitro-1,6-dihydropyrimidin-2-ol
| Molecular Formula | C11H10ClN3O3 |
|---|---|
| Molecular Weight | 267.04 g/mol |
| LogP | 2.2021 |
| Topological Polar Surface Area | 84.27 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 267.04108 |
| Heavy Atoms | 18 |
| Complexity | 556.21936 |
Chemical Identifiers
| CAS Number | 159587-37-8 |
|---|---|
| SMILES | CC1=C(C(NC(=O)N1)C2=CC=CC=C2Cl)[N+](=O)[O-] |
Product Overview
4-(2-chlorophenyl)-6-methyl-5-nitro-3,4-dihydro-1H-pyrimidin-2-one (CAS 159587-37-8), with molecular formula C11H10ClN3O3 and molecular weight 267.04 g/mol. IUPAC: 4-(2-chlorophenyl)-6-methyl-5-nitro-3,4-dihydro-1H-pyrimidin-2-one.
Chemical Property Profile of 4-(2-chlorophenyl)-6-methyl-5-nitro-3,4-dihydro-1H-pyrimidin-2-one
Property Insights of 4-(2-chlorophenyl)-6-methyl-5-nitro-3,4-dihydro-1H-pyrimidin-2-one
The XLogP value of 2.2021 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-(2-chlorophenyl)-6-methyl-5-nitro-3,4-dihydro-1H-pyrimidin-2-one. The TPSA of 84.27 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-(2-chlorophenyl)-6-methyl-5-nitro-3,4-dihydro-1H-pyrimidin-2-one. Following Lipinski's Rule of Five, 4-(2-chlorophenyl)-6-methyl-5-nitro-3,4-dihydro-1H-pyrimidin-2-one has 2 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 4-(2-chlorophenyl)-6-methyl-5-nitro-3,4-dihydro-1H-pyrimidin-2-one?
The CAS number of 4-(2-chlorophenyl)-6-methyl-5-nitro-3,4-dihydro-1H-pyrimidin-2-one is 159587-37-8.
What is the molecular formula of 4-(2-chlorophenyl)-6-methyl-5-nitro-3,4-dihydro-1H-pyrimidin-2-one?
The molecular formula of 4-(2-chlorophenyl)-6-methyl-5-nitro-3,4-dihydro-1H-pyrimidin-2-one is C11H10ClN3O3.
What is the molecular weight of 4-(2-chlorophenyl)-6-methyl-5-nitro-3,4-dihydro-1H-pyrimidin-2-one?
The molecular weight of 4-(2-chlorophenyl)-6-methyl-5-nitro-3,4-dihydro-1H-pyrimidin-2-one is 267.04 g/mol.
Where can I buy 4-(2-chlorophenyl)-6-methyl-5-nitro-3,4-dihydro-1H-pyrimidin-2-one?
You can request a quote for 4-(2-chlorophenyl)-6-methyl-5-nitro-3,4-dihydro-1H-pyrimidin-2-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(2-chlorophenyl)-6-methyl-5-nitro-3,4-dihydro-1H-pyrimidin-2-one?
Yes, KEHONG BIO provides custom synthesis services for 4-(2-chlorophenyl)-6-methyl-5-nitro-3,4-dihydro-1H-pyrimidin-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.