Bionet1_000499
TL;DR: Bionet1_000499 (CAS 337928-59-3) is a chemical compound with molecular formula C16H15F3N4O2S and molecular weight 384.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-methyl-3-[[2-oxo-1-[[3-(trifluoromethyl)phenyl]methyl]pyridine-3-carbonyl]amino]thiourea
Also Known As: Bionet1_000499, N-methyl-2-({2-oxo-1-[3-(trifluoromethyl)benzyl]-1,2-dihydro-3-pyridinyl}carbonyl)-1-hydrazinecarbothioamide, N-[(methylcarbamothioyl)amino]-2-oxo-1-{[3-(trifluoromethyl)phenyl]methyl}-1,2-dihydropyridine-3-carboxamide, 1-methyl-3-[[2-oxo-1-[[3-(trifluoromethyl)phenyl]methyl]pyridine-3-carbonyl]amino]thiourea, 1-[[2-keto-1-[3-(trifluoromethyl)benzyl]nicotinoyl]amino]-3-methyl-thiourea
| Molecular Formula | C16H15F3N4O2S |
|---|---|
| Molecular Weight | 384.09 g/mol |
| LogP | 1.6541 |
| Topological Polar Surface Area | 75.16 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 384.0868 |
| Heavy Atoms | 26 |
| Complexity | 880.28394 |
Chemical Identifiers
| CAS Number | 337928-59-3 |
|---|---|
| SMILES | CNC(=S)NNC(=O)C1=CC=CN(C1=O)CC2=CC(=CC=C2)C(F)(F)F |
Product Overview
Bionet1_000499 (CAS 337928-59-3), with molecular formula C16H15F3N4O2S and molecular weight 384.09 g/mol. IUPAC: 1-methyl-3-[[2-oxo-1-[[3-(trifluoromethyl)phenyl]methyl]pyridine-3-carbonyl]amino]thiourea.
Chemical Property Profile of Bionet1_000499
Property Insights of Bionet1_000499
The XLogP value of 1.6541 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Bionet1_000499. The TPSA of 75.16 Ų falls within the moderate polarity range, balancing permeability and solubility for Bionet1_000499. Following Lipinski's Rule of Five, Bionet1_000499 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 Bionet1_000499?
The CAS number of Bionet1_000499 is 337928-59-3.
What is the molecular formula of Bionet1_000499?
The molecular formula of Bionet1_000499 is C16H15F3N4O2S.
What is the molecular weight of Bionet1_000499?
The molecular weight of Bionet1_000499 is 384.09 g/mol.
Where can I buy Bionet1_000499?
You can request a quote for Bionet1_000499 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Bionet1_000499?
Yes, KEHONG BIO provides custom synthesis services for Bionet1_000499 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.