4-amino-5-(3,4-dichlorophenyl)-1-[3-(4-nitrophenyl)sulfanylpropyl]pyrimidin-2-one
TL;DR: 4-amino-5-(3,4-dichlorophenyl)-1-[3-(4-nitrophenyl)sulfanylpropyl]pyrimidin-2-one (CAS 26159-16-0) is a chemical compound with molecular formula C19H16Cl2N4O3S and molecular weight 450.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-amino-5-(3,4-dichlorophenyl)-1-[3-(4-nitrophenyl)sulfanylpropyl]pyrimidin-2-one
Also Known As: 4-amino-5-(3,4-dichlorophenyl)-1-[3-(4-nitrophenyl)sulfanylpropyl]pyrimidin-2-one, 4-amino-5-(3,4-dichlorophenyl)-1-[3-(4-nitrophenyl)sulfanylp, 4-Amino-5-(3,4-dichlorophenyl)-1-{3-[(4-nitrophenyl)sulfanyl]propyl}pyrimidin-2(1H)-one
| Molecular Formula | C19H16Cl2N4O3S |
|---|---|
| Molecular Weight | 450.03 g/mol |
| LogP | 4.2 |
| Topological Polar Surface Area | 130.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 450.032 |
| Heavy Atoms | 29 |
| Complexity | 677.0 |
Chemical Identifiers
| CAS Number | 26159-16-0 |
|---|---|
| SMILES | C1=CC(=CC=C1[N+](=O)[O-])SCCCN2C=C(C(=NC2=O)N)C3=CC(=C(C=C3)Cl)Cl |
| InChIKey | LMVFNWBJNOWIGW-UHFFFAOYSA-N |
Product Overview
4-amino-5-(3,4-dichlorophenyl)-1-[3-(4-nitrophenyl)sulfanylpropyl]pyrimidin-2-one (CAS 26159-16-0), with molecular formula C19H16Cl2N4O3S and molecular weight 450.03 g/mol. IUPAC: 4-amino-5-(3,4-dichlorophenyl)-1-[3-(4-nitrophenyl)sulfanylpropyl]pyrimidin-2-one.
Chemical Property Profile of 4-amino-5-(3,4-dichlorophenyl)-1-[3-(4-nitrophenyl)sulfanylpropyl]pyrimidin-2-one
Property Insights of 4-amino-5-(3,4-dichlorophenyl)-1-[3-(4-nitrophenyl)sulfanylpropyl]pyrimidin-2-one
The XLogP value of 4.2 indicates that 4-amino-5-(3,4-dichlorophenyl)-1-[3-(4-nitrophenyl)sulfanylpropyl]pyrimidin-2-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 130.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-amino-5-(3,4-dichlorophenyl)-1-[3-(4-nitrophenyl)sulfanylpropyl]pyrimidin-2-one. Following Lipinski's Rule of Five, 4-amino-5-(3,4-dichlorophenyl)-1-[3-(4-nitrophenyl)sulfanylpropyl]pyrimidin-2-one has 1 hydrogen bond donor(s) and 4 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-amino-5-(3,4-dichlorophenyl)-1-[3-(4-nitrophenyl)sulfanylpropyl]pyrimidin-2-one?
The CAS number of 4-amino-5-(3,4-dichlorophenyl)-1-[3-(4-nitrophenyl)sulfanylpropyl]pyrimidin-2-one is 26159-16-0.
What is the molecular formula of 4-amino-5-(3,4-dichlorophenyl)-1-[3-(4-nitrophenyl)sulfanylpropyl]pyrimidin-2-one?
The molecular formula of 4-amino-5-(3,4-dichlorophenyl)-1-[3-(4-nitrophenyl)sulfanylpropyl]pyrimidin-2-one is C19H16Cl2N4O3S.
What is the molecular weight of 4-amino-5-(3,4-dichlorophenyl)-1-[3-(4-nitrophenyl)sulfanylpropyl]pyrimidin-2-one?
The molecular weight of 4-amino-5-(3,4-dichlorophenyl)-1-[3-(4-nitrophenyl)sulfanylpropyl]pyrimidin-2-one is 450.03 g/mol.
Where can I buy 4-amino-5-(3,4-dichlorophenyl)-1-[3-(4-nitrophenyl)sulfanylpropyl]pyrimidin-2-one?
You can request a quote for 4-amino-5-(3,4-dichlorophenyl)-1-[3-(4-nitrophenyl)sulfanylpropyl]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-amino-5-(3,4-dichlorophenyl)-1-[3-(4-nitrophenyl)sulfanylpropyl]pyrimidin-2-one?
Yes, KEHONG BIO provides custom synthesis services for 4-amino-5-(3,4-dichlorophenyl)-1-[3-(4-nitrophenyl)sulfanylpropyl]pyrimidin-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.