1-[[2-(3-benzyl-6-oxo-2,5-dihydro-1H-1,2,4-triazin-5-yl)acetyl]amino]-3-cyclohexylthiourea
TL;DR: 1-[[2-(3-benzyl-6-oxo-2,5-dihydro-1H-1,2,4-triazin-5-yl)acetyl]amino]-3-cyclohexylthiourea (CAS 316187-15-2) is a chemical compound with molecular formula C19H26N6O2S and molecular weight 402.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[[2-(3-benzyl-6-oxo-2,5-dihydro-1H-1,2,4-triazin-5-yl)acetyl]amino]-3-cyclohexylthiourea
Also Known As: 1-[[2-(3-benzyl-6-oxo-2,5-dihydro-1H-1,2,4-triazin-5-yl)acetyl]amino]-3-cyclohexylthiourea, 2-(2-(3-benzyl-6-oxo-1,4,5,6-tetrahydro-1,2,4-triazin-5-yl)acetyl)-N-cyclohexylhydrazinecarbothioamide
| Molecular Formula | C19H26N6O2S |
|---|---|
| Molecular Weight | 402.18 g/mol |
| LogP | 0.8487 |
| Topological Polar Surface Area | 106.65 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 402.1838 |
| Heavy Atoms | 28 |
| Complexity | 733.1992 |
Chemical Identifiers
| CAS Number | 316187-15-2 |
|---|---|
| SMILES | C1CCC(CC1)NC(=S)NNC(=O)CC2C(=O)NNC(=N2)CC3=CC=CC=C3 |
Product Overview
1-[[2-(3-benzyl-6-oxo-2,5-dihydro-1H-1,2,4-triazin-5-yl)acetyl]amino]-3-cyclohexylthiourea (CAS 316187-15-2), with molecular formula C19H26N6O2S and molecular weight 402.18 g/mol. IUPAC: 1-[[2-(3-benzyl-6-oxo-2,5-dihydro-1H-1,2,4-triazin-5-yl)acetyl]amino]-3-cyclohexylthiourea.
Chemical Property Profile of 1-[[2-(3-benzyl-6-oxo-2,5-dihydro-1H-1,2,4-triazin-5-yl)acetyl]amino]-3-cyclohexylthiourea
Property Insights of 1-[[2-(3-benzyl-6-oxo-2,5-dihydro-1H-1,2,4-triazin-5-yl)acetyl]amino]-3-cyclohexylthiourea
The XLogP value of 0.8487 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-[[2-(3-benzyl-6-oxo-2,5-dihydro-1H-1,2,4-triazin-5-yl)acetyl]amino]-3-cyclohexylthiourea. The TPSA of 106.65 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-[[2-(3-benzyl-6-oxo-2,5-dihydro-1H-1,2,4-triazin-5-yl)acetyl]amino]-3-cyclohexylthiourea. Following Lipinski's Rule of Five, 1-[[2-(3-benzyl-6-oxo-2,5-dihydro-1H-1,2,4-triazin-5-yl)acetyl]amino]-3-cyclohexylthiourea has 5 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 1-[[2-(3-benzyl-6-oxo-2,5-dihydro-1H-1,2,4-triazin-5-yl)acetyl]amino]-3-cyclohexylthiourea?
The CAS number of 1-[[2-(3-benzyl-6-oxo-2,5-dihydro-1H-1,2,4-triazin-5-yl)acetyl]amino]-3-cyclohexylthiourea is 316187-15-2.
What is the molecular formula of 1-[[2-(3-benzyl-6-oxo-2,5-dihydro-1H-1,2,4-triazin-5-yl)acetyl]amino]-3-cyclohexylthiourea?
The molecular formula of 1-[[2-(3-benzyl-6-oxo-2,5-dihydro-1H-1,2,4-triazin-5-yl)acetyl]amino]-3-cyclohexylthiourea is C19H26N6O2S.
What is the molecular weight of 1-[[2-(3-benzyl-6-oxo-2,5-dihydro-1H-1,2,4-triazin-5-yl)acetyl]amino]-3-cyclohexylthiourea?
The molecular weight of 1-[[2-(3-benzyl-6-oxo-2,5-dihydro-1H-1,2,4-triazin-5-yl)acetyl]amino]-3-cyclohexylthiourea is 402.18 g/mol.
Where can I buy 1-[[2-(3-benzyl-6-oxo-2,5-dihydro-1H-1,2,4-triazin-5-yl)acetyl]amino]-3-cyclohexylthiourea?
You can request a quote for 1-[[2-(3-benzyl-6-oxo-2,5-dihydro-1H-1,2,4-triazin-5-yl)acetyl]amino]-3-cyclohexylthiourea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-[[2-(3-benzyl-6-oxo-2,5-dihydro-1H-1,2,4-triazin-5-yl)acetyl]amino]-3-cyclohexylthiourea?
Yes, KEHONG BIO provides custom synthesis services for 1-[[2-(3-benzyl-6-oxo-2,5-dihydro-1H-1,2,4-triazin-5-yl)acetyl]amino]-3-cyclohexylthiourea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.