methyl 6-methyl-4-(4-nitrophenyl)-2-thioxo-1,2,3,4-tetrahydr
TL;DR: methyl 6-methyl-4-(4-nitrophenyl)-2-thioxo-1,2,3,4-tetrahydr (CAS 134288-68-9) is a chemical compound with molecular formula C13H13N3O4S and molecular weight 307.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 6-methyl-4-(4-nitrophenyl)-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate
Also Known As: methyl 6-methyl-4-(4-nitrophenyl)-2-thioxo-1,2,3,4-tetrahydr, 6-Methyl-4-(4-nitrophenyl)-2-thioxo-1,2,3,4-tetrahydropyrimidine-5-carboxylic acid methyl ester, methyl 6-methyl-4-(4-nitrophenyl)-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate, methyl 6-methyl-4-(4-nitrophenyl)-2-thioxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate, methyl 6-methyl-4-(4-nitrophenyl)-2-sulfanylidene-1,2,3,4-tetrahydropyrimidine-5-carboxylate
| Molecular Formula | C13H13N3O4S |
|---|---|
| Molecular Weight | 307.06 g/mol |
| LogP | 1.5606 |
| Topological Polar Surface Area | 93.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 307.06268 |
| Heavy Atoms | 21 |
| Complexity | 639.3214 |
Chemical Identifiers
| CAS Number | 134288-68-9 |
|---|---|
| SMILES | CC1=C(C(NC(=S)N1)C2=CC=C(C=C2)[N+](=O)[O-])C(=O)OC |
Product Overview
methyl 6-methyl-4-(4-nitrophenyl)-2-thioxo-1,2,3,4-tetrahydr (CAS 134288-68-9), with molecular formula C13H13N3O4S and molecular weight 307.06 g/mol. IUPAC: methyl 6-methyl-4-(4-nitrophenyl)-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate.
Chemical Property Profile of methyl 6-methyl-4-(4-nitrophenyl)-2-thioxo-1,2,3,4-tetrahydr
Property Insights of methyl 6-methyl-4-(4-nitrophenyl)-2-thioxo-1,2,3,4-tetrahydr
The XLogP value of 1.5606 suggests moderate lipophilicity, balancing water solubility and membrane permeability for methyl 6-methyl-4-(4-nitrophenyl)-2-thioxo-1,2,3,4-tetrahydr. The TPSA of 93.5 Ų falls within the moderate polarity range, balancing permeability and solubility for methyl 6-methyl-4-(4-nitrophenyl)-2-thioxo-1,2,3,4-tetrahydr. Following Lipinski's Rule of Five, methyl 6-methyl-4-(4-nitrophenyl)-2-thioxo-1,2,3,4-tetrahydr 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 methyl 6-methyl-4-(4-nitrophenyl)-2-thioxo-1,2,3,4-tetrahydr?
The CAS number of methyl 6-methyl-4-(4-nitrophenyl)-2-thioxo-1,2,3,4-tetrahydr is 134288-68-9.
What is the molecular formula of methyl 6-methyl-4-(4-nitrophenyl)-2-thioxo-1,2,3,4-tetrahydr?
The molecular formula of methyl 6-methyl-4-(4-nitrophenyl)-2-thioxo-1,2,3,4-tetrahydr is C13H13N3O4S.
What is the molecular weight of methyl 6-methyl-4-(4-nitrophenyl)-2-thioxo-1,2,3,4-tetrahydr?
The molecular weight of methyl 6-methyl-4-(4-nitrophenyl)-2-thioxo-1,2,3,4-tetrahydr is 307.06 g/mol.
Where can I buy methyl 6-methyl-4-(4-nitrophenyl)-2-thioxo-1,2,3,4-tetrahydr?
You can request a quote for methyl 6-methyl-4-(4-nitrophenyl)-2-thioxo-1,2,3,4-tetrahydr directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for methyl 6-methyl-4-(4-nitrophenyl)-2-thioxo-1,2,3,4-tetrahydr?
Yes, KEHONG BIO provides custom synthesis services for methyl 6-methyl-4-(4-nitrophenyl)-2-thioxo-1,2,3,4-tetrahydr and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.