![4-(4-(TRIFLUOROMETHOXY)PHENYL)-1-(2-(2,3,6-TRIAZINO[5,4-B]INDOL-3-YLTHIO)ACETYL)THIOSEMICARBAZIDE structure](/static/products/102/1024581-30-3.png)
4-(4-(TRIFLUOROMETHOXY)PHENYL)-1-(2-(2,3,6-TRIAZINO[5,4-B]INDOL-3-YLTHIO)ACETYL)THIOSEMICARBAZIDE
TL;DR: 4-(4-(TRIFLUOROMETHOXY)PHENYL)-1-(2-(2,3,6-TRIAZINO[5,4-B]INDOL-3-YLTHIO)ACETYL)THIOSEMICARBAZIDE (CAS 1024581-30-3) is a chemical compound with molecular formula C19H14F3N7O2S2 and molecular weight 493.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[[2-(5H-[1,2,4]triazino[5,6-b]indol-3-ylsulfanyl)acetyl]amino]-3-[4-(trifluoromethoxy)phenyl]thiourea
Also Known As: 4-(4-(TRIFLUOROMETHOXY)PHENYL)-1-(2-(2,3,6-TRIAZINO[5,4-B]INDOL-3-YLTHIO)ACETYL)THIOSEMICARBAZIDE, 1-[[2-(5H-[1,2,4]triazino[5,6-b]indol-3-ylsulfanyl)acetyl]amino]-3-[4-(trifluoromethoxy)phenyl]thiourea, 2-{5H-[1,2,4]triazino[5,6-b]indol-3-ylsulfanyl}-N-({[4-(trifluoromethoxy)phenyl]carbamothioyl}amino)acetamide, C19H14F3N7O2S2
| Molecular Formula | C19H14F3N7O2S2 |
|---|---|
| Molecular Weight | 493.06 g/mol |
| LogP | 3.5146 |
| Topological Polar Surface Area | 116.85 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 493.06024 |
| Heavy Atoms | 33 |
| Complexity | 1312.4845 |
Chemical Identifiers
| CAS Number | 1024581-30-3 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C3=C(N2)N=C(N=N3)SCC(=O)NNC(=S)NC4=CC=C(C=C4)OC(F)(F)F |
Product Overview
4-(4-(TRIFLUOROMETHOXY)PHENYL)-1-(2-(2,3,6-TRIAZINO[5,4-B]INDOL-3-YLTHIO)ACETYL)THIOSEMICARBAZIDE (CAS 1024581-30-3), with molecular formula C19H14F3N7O2S2 and molecular weight 493.06 g/mol. IUPAC: 1-[[2-(5H-[1,2,4]triazino[5,6-b]indol-3-ylsulfanyl)acetyl]amino]-3-[4-(trifluoromethoxy)phenyl]thiourea.
Chemical Property Profile of 4-(4-(TRIFLUOROMETHOXY)PHENYL)-1-(2-(2,3,6-TRIAZINO[5,4-B]INDOL-3-YLTHIO)ACETYL)THIOSEMICARBAZIDE
Property Insights of 4-(4-(TRIFLUOROMETHOXY)PHENYL)-1-(2-(2,3,6-TRIAZINO[5,4-B]INDOL-3-YLTHIO)ACETYL)THIOSEMICARBAZIDE
The XLogP value of 3.5146 indicates that 4-(4-(TRIFLUOROMETHOXY)PHENYL)-1-(2-(2,3,6-TRIAZINO[5,4-B]INDOL-3-YLTHIO)ACETYL)THIOSEMICARBAZIDE is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 116.85 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-(4-(TRIFLUOROMETHOXY)PHENYL)-1-(2-(2,3,6-TRIAZINO[5,4-B]INDOL-3-YLTHIO)ACETYL)THIOSEMICARBAZIDE. Following Lipinski's Rule of Five, 4-(4-(TRIFLUOROMETHOXY)PHENYL)-1-(2-(2,3,6-TRIAZINO[5,4-B]INDOL-3-YLTHIO)ACETYL)THIOSEMICARBAZIDE has 4 hydrogen bond donor(s) and 7 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 4-(4-(TRIFLUOROMETHOXY)PHENYL)-1-(2-(2,3,6-TRIAZINO[5,4-B]INDOL-3-YLTHIO)ACETYL)THIOSEMICARBAZIDE?
The CAS number of 4-(4-(TRIFLUOROMETHOXY)PHENYL)-1-(2-(2,3,6-TRIAZINO[5,4-B]INDOL-3-YLTHIO)ACETYL)THIOSEMICARBAZIDE is 1024581-30-3.
What is the molecular formula of 4-(4-(TRIFLUOROMETHOXY)PHENYL)-1-(2-(2,3,6-TRIAZINO[5,4-B]INDOL-3-YLTHIO)ACETYL)THIOSEMICARBAZIDE?
The molecular formula of 4-(4-(TRIFLUOROMETHOXY)PHENYL)-1-(2-(2,3,6-TRIAZINO[5,4-B]INDOL-3-YLTHIO)ACETYL)THIOSEMICARBAZIDE is C19H14F3N7O2S2.
What is the molecular weight of 4-(4-(TRIFLUOROMETHOXY)PHENYL)-1-(2-(2,3,6-TRIAZINO[5,4-B]INDOL-3-YLTHIO)ACETYL)THIOSEMICARBAZIDE?
The molecular weight of 4-(4-(TRIFLUOROMETHOXY)PHENYL)-1-(2-(2,3,6-TRIAZINO[5,4-B]INDOL-3-YLTHIO)ACETYL)THIOSEMICARBAZIDE is 493.06 g/mol.
Where can I buy 4-(4-(TRIFLUOROMETHOXY)PHENYL)-1-(2-(2,3,6-TRIAZINO[5,4-B]INDOL-3-YLTHIO)ACETYL)THIOSEMICARBAZIDE?
You can request a quote for 4-(4-(TRIFLUOROMETHOXY)PHENYL)-1-(2-(2,3,6-TRIAZINO[5,4-B]INDOL-3-YLTHIO)ACETYL)THIOSEMICARBAZIDE directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(4-(TRIFLUOROMETHOXY)PHENYL)-1-(2-(2,3,6-TRIAZINO[5,4-B]INDOL-3-YLTHIO)ACETYL)THIOSEMICARBAZIDE?
Yes, KEHONG BIO provides custom synthesis services for 4-(4-(TRIFLUOROMETHOXY)PHENYL)-1-(2-(2,3,6-TRIAZINO[5,4-B]INDOL-3-YLTHIO)ACETYL)THIOSEMICARBAZIDE and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.