![3H-1,2,4-Triazol-3-one, 5-ethyl-2,4-dihydro-4-[(1-phenylethylidene)amino]- structure](/static/products/7807/780786-37-0.webp)
3H-1,2,4-Triazol-3-one, 5-ethyl-2,4-dihydro-4-[(1-phenylethylidene)amino]-
TL;DR: 3H-1,2,4-Triazol-3-one, 5-ethyl-2,4-dihydro-4-[(1-phenylethylidene)amino]- (CAS 780786-37-0) is a chemical compound with molecular formula C12H14N4O and molecular weight 230.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-ethyl-4-(1-phenylethylideneamino)-1H-1,2,4-triazol-5-one
Also Known As: NCI60_037914, 3-ethyl-4-(1-phenylethylideneamino)-1H-1,2,4-triazol-5-one, 5-ethyl-4-(1-phenylethylideneamino)-2h-1,2,4-triazol-3-one, 3H-1,2,4-TRIAZOL-3-ONE, 5-ETHYL-2,4-DIHYDRO-4-[(1-PHENYLETHYLIDENE)AMINO]-, 3H-1,2,4-Triazol-3-one, 5-ethyl-2,4-dihydro-4-[(1-phenylethylidene)amino]- (9CI)
| Molecular Formula | C12H14N4O |
|---|---|
| Molecular Weight | 230.12 g/mol |
| LogP | 1.7 |
| Topological Polar Surface Area | 57.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 230.11676 |
| Heavy Atoms | 17 |
| Complexity | 356.0 |
Chemical Identifiers
| CAS Number | 780786-37-0 |
|---|---|
| SMILES | CCC1=NNC(=O)N1N=C(C)C2=CC=CC=C2 |
| InChIKey | DMEXIJZPEXEDEJ-UHFFFAOYSA-N |
Product Overview
3H-1,2,4-Triazol-3-one, 5-ethyl-2,4-dihydro-4-[(1-phenylethylidene)amino]- (CAS 780786-37-0), with molecular formula C12H14N4O and molecular weight 230.12 g/mol. IUPAC: 3-ethyl-4-(1-phenylethylideneamino)-1H-1,2,4-triazol-5-one.
Chemical Property Profile of 3H-1,2,4-Triazol-3-one, 5-ethyl-2,4-dihydro-4-[(1-phenylethylidene)amino]-
Property Insights of 3H-1,2,4-Triazol-3-one, 5-ethyl-2,4-dihydro-4-[(1-phenylethylidene)amino]-
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3H-1,2,4-Triazol-3-one, 5-ethyl-2,4-dihydro-4-[(1-phenylethylidene)amino]-. With a topological polar surface area (TPSA) of 57.1 Ų, 3H-1,2,4-Triazol-3-one, 5-ethyl-2,4-dihydro-4-[(1-phenylethylidene)amino]- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3H-1,2,4-Triazol-3-one, 5-ethyl-2,4-dihydro-4-[(1-phenylethylidene)amino]- has 1 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 3H-1,2,4-Triazol-3-one, 5-ethyl-2,4-dihydro-4-[(1-phenylethylidene)amino]-?
The CAS number of 3H-1,2,4-Triazol-3-one, 5-ethyl-2,4-dihydro-4-[(1-phenylethylidene)amino]- is 780786-37-0.
What is the molecular formula of 3H-1,2,4-Triazol-3-one, 5-ethyl-2,4-dihydro-4-[(1-phenylethylidene)amino]-?
The molecular formula of 3H-1,2,4-Triazol-3-one, 5-ethyl-2,4-dihydro-4-[(1-phenylethylidene)amino]- is C12H14N4O.
What is the molecular weight of 3H-1,2,4-Triazol-3-one, 5-ethyl-2,4-dihydro-4-[(1-phenylethylidene)amino]-?
The molecular weight of 3H-1,2,4-Triazol-3-one, 5-ethyl-2,4-dihydro-4-[(1-phenylethylidene)amino]- is 230.12 g/mol.
Where can I buy 3H-1,2,4-Triazol-3-one, 5-ethyl-2,4-dihydro-4-[(1-phenylethylidene)amino]-?
You can request a quote for 3H-1,2,4-Triazol-3-one, 5-ethyl-2,4-dihydro-4-[(1-phenylethylidene)amino]- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3H-1,2,4-Triazol-3-one, 5-ethyl-2,4-dihydro-4-[(1-phenylethylidene)amino]-?
Yes, KEHONG BIO provides custom synthesis services for 3H-1,2,4-Triazol-3-one, 5-ethyl-2,4-dihydro-4-[(1-phenylethylidene)amino]- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.