N-(5-Chloro-2-methylphenyl)-1,2,3,4-tetrahydro-6-methyl-4-(1-naphthalenyl)-2-thioxo-5-pyrimidinecarboxamide
TL;DR: N-(5-Chloro-2-methylphenyl)-1,2,3,4-tetrahydro-6-methyl-4-(1-naphthalenyl)-2-thioxo-5-pyrimidinecarboxamide (CAS 424817-16-3) is a chemical compound with molecular formula C23H20ClN3OS and molecular weight 421.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(5-chloro-2-methylphenyl)-6-methyl-4-naphthalen-1-yl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxamide
Also Known As: N-(5-Chloro-2-methylphenyl)-1,2,3,4-tetrahydro-6-methyl-4-(1-naphthalenyl)-2-thioxo-5-pyrimidinecarboxamide, N-(5-chloro-2-methylphenyl)-6-methyl-4-naphthalen-1-yl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxamide, N-(5-chloro-2-methylphenyl)-6-methyl-4-(1-naphthyl)-2-thioxo-1,2,3,4-tetrahydro-5-pyrimidinecarboxamide
| Molecular Formula | C23H20ClN3OS |
|---|---|
| Molecular Weight | 421.10 g/mol |
| LogP | 5.23312 |
| Topological Polar Surface Area | 53.16 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 421.10156 |
| Heavy Atoms | 29 |
| Complexity | 1166.5016 |
Chemical Identifiers
| CAS Number | 424817-16-3 |
|---|---|
| SMILES | CC1=C(C=C(C=C1)Cl)NC(=O)C2=C(NC(=S)NC2C3=CC=CC4=CC=CC=C43)C |
Product Overview
N-(5-Chloro-2-methylphenyl)-1,2,3,4-tetrahydro-6-methyl-4-(1-naphthalenyl)-2-thioxo-5-pyrimidinecarboxamide (CAS 424817-16-3), with molecular formula C23H20ClN3OS and molecular weight 421.10 g/mol. IUPAC: N-(5-chloro-2-methylphenyl)-6-methyl-4-naphthalen-1-yl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxamide.
Chemical Property Profile of N-(5-Chloro-2-methylphenyl)-1,2,3,4-tetrahydro-6-methyl-4-(1-naphthalenyl)-2-thioxo-5-pyrimidinecarboxamide
Property Insights of N-(5-Chloro-2-methylphenyl)-1,2,3,4-tetrahydro-6-methyl-4-(1-naphthalenyl)-2-thioxo-5-pyrimidinecarboxamide
The XLogP value of 5.23312 indicates that N-(5-Chloro-2-methylphenyl)-1,2,3,4-tetrahydro-6-methyl-4-(1-naphthalenyl)-2-thioxo-5-pyrimidinecarboxamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 53.16 Ų, N-(5-Chloro-2-methylphenyl)-1,2,3,4-tetrahydro-6-methyl-4-(1-naphthalenyl)-2-thioxo-5-pyrimidinecarboxamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(5-Chloro-2-methylphenyl)-1,2,3,4-tetrahydro-6-methyl-4-(1-naphthalenyl)-2-thioxo-5-pyrimidinecarboxamide has 3 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of N-(5-Chloro-2-methylphenyl)-1,2,3,4-tetrahydro-6-methyl-4-(1-naphthalenyl)-2-thioxo-5-pyrimidinecarboxamide?
The CAS number of N-(5-Chloro-2-methylphenyl)-1,2,3,4-tetrahydro-6-methyl-4-(1-naphthalenyl)-2-thioxo-5-pyrimidinecarboxamide is 424817-16-3.
What is the molecular formula of N-(5-Chloro-2-methylphenyl)-1,2,3,4-tetrahydro-6-methyl-4-(1-naphthalenyl)-2-thioxo-5-pyrimidinecarboxamide?
The molecular formula of N-(5-Chloro-2-methylphenyl)-1,2,3,4-tetrahydro-6-methyl-4-(1-naphthalenyl)-2-thioxo-5-pyrimidinecarboxamide is C23H20ClN3OS.
What is the molecular weight of N-(5-Chloro-2-methylphenyl)-1,2,3,4-tetrahydro-6-methyl-4-(1-naphthalenyl)-2-thioxo-5-pyrimidinecarboxamide?
The molecular weight of N-(5-Chloro-2-methylphenyl)-1,2,3,4-tetrahydro-6-methyl-4-(1-naphthalenyl)-2-thioxo-5-pyrimidinecarboxamide is 421.10 g/mol.
Where can I buy N-(5-Chloro-2-methylphenyl)-1,2,3,4-tetrahydro-6-methyl-4-(1-naphthalenyl)-2-thioxo-5-pyrimidinecarboxamide?
You can request a quote for N-(5-Chloro-2-methylphenyl)-1,2,3,4-tetrahydro-6-methyl-4-(1-naphthalenyl)-2-thioxo-5-pyrimidinecarboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(5-Chloro-2-methylphenyl)-1,2,3,4-tetrahydro-6-methyl-4-(1-naphthalenyl)-2-thioxo-5-pyrimidinecarboxamide?
Yes, KEHONG BIO provides custom synthesis services for N-(5-Chloro-2-methylphenyl)-1,2,3,4-tetrahydro-6-methyl-4-(1-naphthalenyl)-2-thioxo-5-pyrimidinecarboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.