VU0608659-1
TL;DR: VU0608659-1 (CAS 959271-22-8) is a chemical compound with molecular formula C18H21N5OS and molecular weight 355.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(1-ethyl-3-methylpyrazol-4-yl)-6-methyl-N-phenyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxamide
Also Known As: VU0608659-1, 4-(1-Ethyl-3-methyl-1H-pyrazol-4-yl)-6-methyl-N-phenyl-2-thioxo-1,2,3,4-tetrahydro-5-pyrimidinecarboxamide, 4-(1-ethyl-3-methylpyrazol-4-yl)-6-methyl-N-phenyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxamide, 4-(1-ethyl-3-methyl-1H-pyrazol-4-yl)-6-methyl-N-phenyl-2-sulfanylidene-1,2,3,4-tetrahydropyrimidine-5-carboxamide, 4-(1-Ethyl-3-methyl-1H-pyrazol-4-yl)-6-methyl-2-thioxo-1,2,3,4-tetrahydro-pyrimidine-5-carboxylic acid phenylamide
| Molecular Formula | C18H21N5OS |
|---|---|
| Molecular Weight | 355.15 g/mol |
| LogP | 2.64292 |
| Topological Polar Surface Area | 70.98 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 355.14667 |
| Heavy Atoms | 25 |
| Complexity | 840.40625 |
Chemical Identifiers
| CAS Number | 959271-22-8 |
|---|---|
| SMILES | CCN1C=C(C(=N1)C)C2C(=C(NC(=S)N2)C)C(=O)NC3=CC=CC=C3 |
Product Overview
VU0608659-1 (CAS 959271-22-8), with molecular formula C18H21N5OS and molecular weight 355.15 g/mol. IUPAC: 4-(1-ethyl-3-methylpyrazol-4-yl)-6-methyl-N-phenyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxamide.
Chemical Property Profile of VU0608659-1
Property Insights of VU0608659-1
The XLogP value of 2.64292 suggests moderate lipophilicity, balancing water solubility and membrane permeability for VU0608659-1. The TPSA of 70.98 Ų falls within the moderate polarity range, balancing permeability and solubility for VU0608659-1. Following Lipinski's Rule of Five, VU0608659-1 has 3 hydrogen bond donor(s) and 3 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 VU0608659-1?
The CAS number of VU0608659-1 is 959271-22-8.
What is the molecular formula of VU0608659-1?
The molecular formula of VU0608659-1 is C18H21N5OS.
What is the molecular weight of VU0608659-1?
The molecular weight of VU0608659-1 is 355.15 g/mol.
Where can I buy VU0608659-1?
You can request a quote for VU0608659-1 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for VU0608659-1?
Yes, KEHONG BIO provides custom synthesis services for VU0608659-1 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.