![4-{[(Z)-1-phenylmethylidene]amino}-2,4-dihydro-3H-1,2,4-triazole-3-thione structure](/static/products/1631/1631974-37-2.webp)
4-{[(Z)-1-phenylmethylidene]amino}-2,4-dihydro-3H-1,2,4-triazole-3-thione
TL;DR: 4-{[(Z)-1-phenylmethylidene]amino}-2,4-dihydro-3H-1,2,4-triazole-3-thione (CAS 1631974-37-2) is a chemical compound with molecular formula C9H8N4S and molecular weight 204.04697 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-[(Z)-benzylideneamino]-1H-1,2,4-triazole-5-thione
Also Known As: 4-[(Z)-benzylideneamino]-1H-1,2,4-triazole-5-thione, 4-[(E)-(phenylmethylidene)amino]-4H-1,2,4-triazole-3-thiol, 4-{[(Z)-1-phenylmethylidene]amino}-2,4-dihydro-3H-1,2,4-triazole-3-thione
Technical Specifications
| Molecular Formula | C9H8N4S |
| Molecular Weight | 204.04697 g/mol |
| XLogP | 1.6 |
| Topological Polar Surface Area (TPSA) | 72.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 204.04697 Da |
| Heavy Atoms | 14 |
| Complexity | 268.0 |
| SMILES | C1=CC=C(C=C1)/C=N\N2C=NNC2=S |
| InChIKey | SOJDFRMKXRGAEQ-WDZFZDKYSA-N |
Chemical Property Profile of 4-{[(Z)-1-phenylmethylidene]amino}-2,4-dihydro-3H-1,2,4-triazole-3-thione
Property Insights of 4-{[(Z)-1-phenylmethylidene]amino}-2,4-dihydro-3H-1,2,4-triazole-3-thione
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-{[(Z)-1-phenylmethylidene]amino}-2,4-dihydro-3H-1,2,4-triazole-3-thione. The TPSA of 72.1 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-{[(Z)-1-phenylmethylidene]amino}-2,4-dihydro-3H-1,2,4-triazole-3-thione. Following Lipinski's Rule of Five, 4-{[(Z)-1-phenylmethylidene]amino}-2,4-dihydro-3H-1,2,4-triazole-3-thione 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
What is the CAS number of 4-{[(Z)-1-phenylmethylidene]amino}-2,4-dihydro-3H-1,2,4-triazole-3-thione?
The CAS number of 4-{[(Z)-1-phenylmethylidene]amino}-2,4-dihydro-3H-1,2,4-triazole-3-thione is 1631974-37-2.
What is the molecular formula of 4-{[(Z)-1-phenylmethylidene]amino}-2,4-dihydro-3H-1,2,4-triazole-3-thione?
The molecular formula of 4-{[(Z)-1-phenylmethylidene]amino}-2,4-dihydro-3H-1,2,4-triazole-3-thione is C9H8N4S.
What is the molecular weight of 4-{[(Z)-1-phenylmethylidene]amino}-2,4-dihydro-3H-1,2,4-triazole-3-thione?
The molecular weight of 4-{[(Z)-1-phenylmethylidene]amino}-2,4-dihydro-3H-1,2,4-triazole-3-thione is 204.04697 g/mol.
Where can I buy 4-{[(Z)-1-phenylmethylidene]amino}-2,4-dihydro-3H-1,2,4-triazole-3-thione?
You can request a quote for 4-{[(Z)-1-phenylmethylidene]amino}-2,4-dihydro-3H-1,2,4-triazole-3-thione directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 4-{[(Z)-1-phenylmethylidene]amino}-2,4-dihydro-3H-1,2,4-triazole-3-thione?
Yes, CoreyChem provides custom synthesis services for 4-{[(Z)-1-phenylmethylidene]amino}-2,4-dihydro-3H-1,2,4-triazole-3-thione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.