![2-(2-(1H-benzo[d][1,2,3]triazol-1-yl)-2-oxoethyl)-4,4a,5,5a,6,6a-hexahydro-4,6-ethenocyclopropa[f]isoindole-1,3(2H,3aH)-dione structure](/static/products/1022/1022802-41-0.webp)
2-(2-(1H-benzo[d][1,2,3]triazol-1-yl)-2-oxoethyl)-4,4a,5,5a,6,6a-hexahydro-4,6-ethenocyclopropa[f]isoindole-1,3(2H,3aH)-dione
TL;DR: 2-(2-(1H-benzo[d][1,2,3]triazol-1-yl)-2-oxoethyl)-4,4a,5,5a,6,6a-hexahydro-4,6-ethenocyclopropa[f]isoindole-1,3(2H,3aH)-dione (CAS 1022802-41-0) is a chemical compound with molecular formula C19H16N4O3 and molecular weight 348.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[2-(benzotriazol-1-yl)-2-oxoethyl]-4-azatetracyclo[5.3.2.02,6.08,10]dodec-11-ene-3,5-dione
Also Known As: 2-(2-(1H-benzo[d][1,2,3]triazol-1-yl)-2-oxoethyl)-4,4a,5,5a,6,6a-hexahydro-4,6-ethenocyclopropa[f]isoindole-1,3(2H,3aH)-dione, 2-[2-(1H-benzotriazol-1-yl)-2-oxoethyl]hexahydro-4,6-ethenocyclopropa[f]isoindole-1,3(2H,3aH)-dione, 4-[2-(1H-1,2,3-BENZOTRIAZOL-1-YL)-2-OXOETHYL]-4-AZATETRACYCLO[5.3.2.0~2,6~.0~8,10~]DODEC-11-ENE-3,5-DIONE
| Molecular Formula | C19H16N4O3 |
|---|---|
| Molecular Weight | 348.12 g/mol |
| LogP | 1.1246 |
| Topological Polar Surface Area | 85.16 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 348.12225 |
| Heavy Atoms | 26 |
| Complexity | 988.71564 |
Chemical Identifiers
| CAS Number | 1022802-41-0 |
|---|---|
| SMILES | C1C2C1C3C=CC2C4C3C(=O)N(C4=O)CC(=O)N5C6=CC=CC=C6N=N5 |
Product Overview
2-(2-(1H-benzo[d][1,2,3]triazol-1-yl)-2-oxoethyl)-4,4a,5,5a,6,6a-hexahydro-4,6-ethenocyclopropa[f]isoindole-1,3(2H,3aH)-dione (CAS 1022802-41-0), with molecular formula C19H16N4O3 and molecular weight 348.12 g/mol. IUPAC: 4-[2-(benzotriazol-1-yl)-2-oxoethyl]-4-azatetracyclo[5.3.2.02,6.08,10]dodec-11-ene-3,5-dione.
Chemical Property Profile of 2-(2-(1H-benzo[d][1,2,3]triazol-1-yl)-2-oxoethyl)-4,4a,5,5a,6,6a-hexahydro-4,6-ethenocyclopropa[f]isoindole-1,3(2H,3aH)-dione
Property Insights of 2-(2-(1H-benzo[d][1,2,3]triazol-1-yl)-2-oxoethyl)-4,4a,5,5a,6,6a-hexahydro-4,6-ethenocyclopropa[f]isoindole-1,3(2H,3aH)-dione
The XLogP value of 1.1246 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(2-(1H-benzo[d][1,2,3]triazol-1-yl)-2-oxoethyl)-4,4a,5,5a,6,6a-hexahydro-4,6-ethenocyclopropa[f]isoindole-1,3(2H,3aH)-dione. The TPSA of 85.16 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(2-(1H-benzo[d][1,2,3]triazol-1-yl)-2-oxoethyl)-4,4a,5,5a,6,6a-hexahydro-4,6-ethenocyclopropa[f]isoindole-1,3(2H,3aH)-dione. Following Lipinski's Rule of Five, 2-(2-(1H-benzo[d][1,2,3]triazol-1-yl)-2-oxoethyl)-4,4a,5,5a,6,6a-hexahydro-4,6-ethenocyclopropa[f]isoindole-1,3(2H,3aH)-dione has 0 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 2-(2-(1H-benzo[d][1,2,3]triazol-1-yl)-2-oxoethyl)-4,4a,5,5a,6,6a-hexahydro-4,6-ethenocyclopropa[f]isoindole-1,3(2H,3aH)-dione?
The CAS number of 2-(2-(1H-benzo[d][1,2,3]triazol-1-yl)-2-oxoethyl)-4,4a,5,5a,6,6a-hexahydro-4,6-ethenocyclopropa[f]isoindole-1,3(2H,3aH)-dione is 1022802-41-0.
What is the molecular formula of 2-(2-(1H-benzo[d][1,2,3]triazol-1-yl)-2-oxoethyl)-4,4a,5,5a,6,6a-hexahydro-4,6-ethenocyclopropa[f]isoindole-1,3(2H,3aH)-dione?
The molecular formula of 2-(2-(1H-benzo[d][1,2,3]triazol-1-yl)-2-oxoethyl)-4,4a,5,5a,6,6a-hexahydro-4,6-ethenocyclopropa[f]isoindole-1,3(2H,3aH)-dione is C19H16N4O3.
What is the molecular weight of 2-(2-(1H-benzo[d][1,2,3]triazol-1-yl)-2-oxoethyl)-4,4a,5,5a,6,6a-hexahydro-4,6-ethenocyclopropa[f]isoindole-1,3(2H,3aH)-dione?
The molecular weight of 2-(2-(1H-benzo[d][1,2,3]triazol-1-yl)-2-oxoethyl)-4,4a,5,5a,6,6a-hexahydro-4,6-ethenocyclopropa[f]isoindole-1,3(2H,3aH)-dione is 348.12 g/mol.
Where can I buy 2-(2-(1H-benzo[d][1,2,3]triazol-1-yl)-2-oxoethyl)-4,4a,5,5a,6,6a-hexahydro-4,6-ethenocyclopropa[f]isoindole-1,3(2H,3aH)-dione?
You can request a quote for 2-(2-(1H-benzo[d][1,2,3]triazol-1-yl)-2-oxoethyl)-4,4a,5,5a,6,6a-hexahydro-4,6-ethenocyclopropa[f]isoindole-1,3(2H,3aH)-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(2-(1H-benzo[d][1,2,3]triazol-1-yl)-2-oxoethyl)-4,4a,5,5a,6,6a-hexahydro-4,6-ethenocyclopropa[f]isoindole-1,3(2H,3aH)-dione?
Yes, KEHONG BIO provides custom synthesis services for 2-(2-(1H-benzo[d][1,2,3]triazol-1-yl)-2-oxoethyl)-4,4a,5,5a,6,6a-hexahydro-4,6-ethenocyclopropa[f]isoindole-1,3(2H,3aH)-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.