NCI60_033443
TL;DR: NCI60_033443 (CAS 51944-22-0) is a chemical compound with molecular formula C19H20N4OS and molecular weight 352.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)-3-(4-methylphenyl)thiourea
Also Known As: NCI60_033443, F0331-0104, 1-(1,5-Dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)-3-p-tolyl-thiourea, N-(1,5-Dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)-N'-(4-methylphenyl)thiourea, 1-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)-3-(4-methylphenyl)thiourea
| Molecular Formula | C19H20N4OS |
|---|---|
| Molecular Weight | 352.14 g/mol |
| LogP | 3.60174 |
| Topological Polar Surface Area | 50.99 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 352.13577 |
| Heavy Atoms | 25 |
| Complexity | 955.58435 |
Chemical Identifiers
| CAS Number | 51944-22-0 |
|---|---|
| SMILES | CC1=CC=C(C=C1)NC(=S)NC2=C(N(N(C2=O)C3=CC=CC=C3)C)C |
Product Overview
NCI60_033443 (CAS 51944-22-0), with molecular formula C19H20N4OS and molecular weight 352.14 g/mol. IUPAC: 1-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)-3-(4-methylphenyl)thiourea.
Chemical Property Profile of NCI60_033443
Property Insights of NCI60_033443
The XLogP value of 3.60174 indicates that NCI60_033443 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 50.99 Ų, NCI60_033443 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, NCI60_033443 has 2 hydrogen bond donor(s) and 2 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 NCI60_033443?
The CAS number of NCI60_033443 is 51944-22-0.
What is the molecular formula of NCI60_033443?
The molecular formula of NCI60_033443 is C19H20N4OS.
What is the molecular weight of NCI60_033443?
The molecular weight of NCI60_033443 is 352.14 g/mol.
Where can I buy NCI60_033443?
You can request a quote for NCI60_033443 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for NCI60_033443?
Yes, KEHONG BIO provides custom synthesis services for NCI60_033443 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.