2(1H)-Pyridinone, 4-((3,5-dimethylphenyl)thio)-6-(3-hydroxypropyl)-3-nitro-
TL;DR: 2(1H)-Pyridinone, 4-((3,5-dimethylphenyl)thio)-6-(3-hydroxypropyl)-3-nitro- (CAS 175437-65-7) is a chemical compound with molecular formula C16H18N2O4S and molecular weight 334.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(3,5-dimethylphenyl)sulfanyl-6-(3-hydroxypropyl)-3-nitro-1H-pyridin-2-one
Also Known As: HEPT analog, 4-PhS-3-NO2-2-Pyridinone deriv., 2(1H)-Pyridinone, 4-((3,5-dimethylphenyl)thio)-6-(3-hydroxypropyl)-3-nitro-, 4-(3,5-dimethylphenyl)sulfanyl-6-(3-hydroxypropyl)-3-nitro-1H-pyridin-2-one, T0513-3001
| Molecular Formula | C16H18N2O4S |
|---|---|
| Molecular Weight | 334.10 g/mol |
| LogP | 2.7 |
| Topological Polar Surface Area | 120.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 334.09872 |
| Heavy Atoms | 23 |
| Complexity | 529.0 |
Chemical Identifiers
| CAS Number | 175437-65-7 |
|---|---|
| SMILES | CC1=CC(=CC(=C1)SC2=C(C(=O)NC(=C2)CCCO)[N+](=O)[O-])C |
| InChIKey | ICOIGDZBWMLCKW-UHFFFAOYSA-N |
Product Overview
2(1H)-Pyridinone, 4-((3,5-dimethylphenyl)thio)-6-(3-hydroxypropyl)-3-nitro- (CAS 175437-65-7), with molecular formula C16H18N2O4S and molecular weight 334.10 g/mol. IUPAC: 4-(3,5-dimethylphenyl)sulfanyl-6-(3-hydroxypropyl)-3-nitro-1H-pyridin-2-one.
Chemical Property Profile of 2(1H)-Pyridinone, 4-((3,5-dimethylphenyl)thio)-6-(3-hydroxypropyl)-3-nitro-
Property Insights of 2(1H)-Pyridinone, 4-((3,5-dimethylphenyl)thio)-6-(3-hydroxypropyl)-3-nitro-
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2(1H)-Pyridinone, 4-((3,5-dimethylphenyl)thio)-6-(3-hydroxypropyl)-3-nitro-. The TPSA of 120.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2(1H)-Pyridinone, 4-((3,5-dimethylphenyl)thio)-6-(3-hydroxypropyl)-3-nitro-. Following Lipinski's Rule of Five, 2(1H)-Pyridinone, 4-((3,5-dimethylphenyl)thio)-6-(3-hydroxypropyl)-3-nitro- has 2 hydrogen bond donor(s) and 5 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 2(1H)-Pyridinone, 4-((3,5-dimethylphenyl)thio)-6-(3-hydroxypropyl)-3-nitro-?
The CAS number of 2(1H)-Pyridinone, 4-((3,5-dimethylphenyl)thio)-6-(3-hydroxypropyl)-3-nitro- is 175437-65-7.
What is the molecular formula of 2(1H)-Pyridinone, 4-((3,5-dimethylphenyl)thio)-6-(3-hydroxypropyl)-3-nitro-?
The molecular formula of 2(1H)-Pyridinone, 4-((3,5-dimethylphenyl)thio)-6-(3-hydroxypropyl)-3-nitro- is C16H18N2O4S.
What is the molecular weight of 2(1H)-Pyridinone, 4-((3,5-dimethylphenyl)thio)-6-(3-hydroxypropyl)-3-nitro-?
The molecular weight of 2(1H)-Pyridinone, 4-((3,5-dimethylphenyl)thio)-6-(3-hydroxypropyl)-3-nitro- is 334.10 g/mol.
Where can I buy 2(1H)-Pyridinone, 4-((3,5-dimethylphenyl)thio)-6-(3-hydroxypropyl)-3-nitro-?
You can request a quote for 2(1H)-Pyridinone, 4-((3,5-dimethylphenyl)thio)-6-(3-hydroxypropyl)-3-nitro- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2(1H)-Pyridinone, 4-((3,5-dimethylphenyl)thio)-6-(3-hydroxypropyl)-3-nitro-?
Yes, KEHONG BIO provides custom synthesis services for 2(1H)-Pyridinone, 4-((3,5-dimethylphenyl)thio)-6-(3-hydroxypropyl)-3-nitro- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.