(E)-5-nitro-6-(4-(p-tolylthio)styryl)pyrimidine-2,4(1H,3H)-dione
TL;DR: (E)-5-nitro-6-(4-(p-tolylthio)styryl)pyrimidine-2,4(1H,3H)-dione (CAS 831208-90-3) is a chemical compound with molecular formula C19H15N3O4S and molecular weight 381.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-[(E)-2-[4-(4-methylphenyl)sulfanylphenyl]ethenyl]-5-nitro-1H-pyrimidine-2,4-dione
Also Known As: (E)-5-nitro-6-(4-(p-tolylthio)styryl)pyrimidine-2,4(1H,3H)-dione, 6-(2-{4-[(4-methylphenyl)thio]phenyl}vinyl)-5-nitro-2,4(1H,3H)-pyrimidinedione, 6-[(E)-2-[4-(4-methylphenyl)sulfanylphenyl]ethenyl]-5-nitro-1H-pyrimidine-2,4-dione, 6-[(E)-2-{4-[(4-methylphenyl)sulfanyl]phenyl}ethenyl]-5-nitropyrimidine-2,4-diol
| Molecular Formula | C19H15N3O4S |
|---|---|
| Molecular Weight | 381.08 g/mol |
| LogP | 3.60142 |
| Topological Polar Surface Area | 108.86 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 381.07834 |
| Heavy Atoms | 27 |
| Complexity | 1113.432 |
Chemical Identifiers
| CAS Number | 831208-90-3 |
|---|---|
| SMILES | CC1=CC=C(C=C1)SC2=CC=C(C=C2)/C=C/C3=C(C(=O)NC(=O)N3)[N+](=O)[O-] |
Product Overview
(E)-5-nitro-6-(4-(p-tolylthio)styryl)pyrimidine-2,4(1H,3H)-dione (CAS 831208-90-3), with molecular formula C19H15N3O4S and molecular weight 381.08 g/mol. IUPAC: 6-[(E)-2-[4-(4-methylphenyl)sulfanylphenyl]ethenyl]-5-nitro-1H-pyrimidine-2,4-dione.
Chemical Property Profile of (E)-5-nitro-6-(4-(p-tolylthio)styryl)pyrimidine-2,4(1H,3H)-dione
Property Insights of (E)-5-nitro-6-(4-(p-tolylthio)styryl)pyrimidine-2,4(1H,3H)-dione
The XLogP value of 3.60142 indicates that (E)-5-nitro-6-(4-(p-tolylthio)styryl)pyrimidine-2,4(1H,3H)-dione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 108.86 Ų falls within the moderate polarity range, balancing permeability and solubility for (E)-5-nitro-6-(4-(p-tolylthio)styryl)pyrimidine-2,4(1H,3H)-dione. Following Lipinski's Rule of Five, (E)-5-nitro-6-(4-(p-tolylthio)styryl)pyrimidine-2,4(1H,3H)-dione 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 (E)-5-nitro-6-(4-(p-tolylthio)styryl)pyrimidine-2,4(1H,3H)-dione?
The CAS number of (E)-5-nitro-6-(4-(p-tolylthio)styryl)pyrimidine-2,4(1H,3H)-dione is 831208-90-3.
What is the molecular formula of (E)-5-nitro-6-(4-(p-tolylthio)styryl)pyrimidine-2,4(1H,3H)-dione?
The molecular formula of (E)-5-nitro-6-(4-(p-tolylthio)styryl)pyrimidine-2,4(1H,3H)-dione is C19H15N3O4S.
What is the molecular weight of (E)-5-nitro-6-(4-(p-tolylthio)styryl)pyrimidine-2,4(1H,3H)-dione?
The molecular weight of (E)-5-nitro-6-(4-(p-tolylthio)styryl)pyrimidine-2,4(1H,3H)-dione is 381.08 g/mol.
Where can I buy (E)-5-nitro-6-(4-(p-tolylthio)styryl)pyrimidine-2,4(1H,3H)-dione?
You can request a quote for (E)-5-nitro-6-(4-(p-tolylthio)styryl)pyrimidine-2,4(1H,3H)-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (E)-5-nitro-6-(4-(p-tolylthio)styryl)pyrimidine-2,4(1H,3H)-dione?
Yes, KEHONG BIO provides custom synthesis services for (E)-5-nitro-6-(4-(p-tolylthio)styryl)pyrimidine-2,4(1H,3H)-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.