6-[2-[3-(1,3-Benzodioxol-5-yl)-1-methylpropylidene]hydrazinyl]-1,2,4-triazine-3,5(2H,4H)-dione
TL;DR: 6-[2-[3-(1,3-Benzodioxol-5-yl)-1-methylpropylidene]hydrazinyl]-1,2,4-triazine-3,5(2H,4H)-dione (CAS 380436-77-1) is a chemical compound with molecular formula C14H15N5O4 and molecular weight 317.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-[2-[4-(1,3-benzodioxol-5-yl)butan-2-ylidene]hydrazinyl]-2H-1,2,4-triazine-3,5-dione
Also Known As: 6-[2-[3-(1,3-Benzodioxol-5-yl)-1-methylpropylidene]hydrazinyl]-1,2,4-triazine-3,5(2H,4H)-dione, 6-(2-(4-benzo[1,3]dioxol-5-ylbutan-2-ylidene)hydrazinyl)-2H-1,2,4-triazine-3,5-dione, 6-[2-[4-(1,3-benzodioxol-5-yl)butan-2-ylidene]hydrazinyl]-2H-1,2,4-triazine-3,5-dione, 6-{2-[4-(2H-1,3-Benzodioxol-5-yl)butan-2-ylidene]hydrazinyl}-1,2,4-triazine-3,5(2H,4H)-dione
| Molecular Formula | C14H15N5O4 |
|---|---|
| Molecular Weight | 317.11 g/mol |
| LogP | 0.6075 |
| Topological Polar Surface Area | 121.46 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 317.1124 |
| Heavy Atoms | 23 |
| Complexity | 854.7315 |
Chemical Identifiers
| CAS Number | 380436-77-1 |
|---|---|
| SMILES | CC(=NNC1=NNC(=O)NC1=O)CCC2=CC3=C(C=C2)OCO3 |
Product Overview
6-[2-[3-(1,3-Benzodioxol-5-yl)-1-methylpropylidene]hydrazinyl]-1,2,4-triazine-3,5(2H,4H)-dione (CAS 380436-77-1), with molecular formula C14H15N5O4 and molecular weight 317.11 g/mol. IUPAC: 6-[2-[4-(1,3-benzodioxol-5-yl)butan-2-ylidene]hydrazinyl]-2H-1,2,4-triazine-3,5-dione.
Chemical Property Profile of 6-[2-[3-(1,3-Benzodioxol-5-yl)-1-methylpropylidene]hydrazinyl]-1,2,4-triazine-3,5(2H,4H)-dione
Property Insights of 6-[2-[3-(1,3-Benzodioxol-5-yl)-1-methylpropylidene]hydrazinyl]-1,2,4-triazine-3,5(2H,4H)-dione
The XLogP value of 0.6075 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6-[2-[3-(1,3-Benzodioxol-5-yl)-1-methylpropylidene]hydrazinyl]-1,2,4-triazine-3,5(2H,4H)-dione. The TPSA of 121.46 Ų falls within the moderate polarity range, balancing permeability and solubility for 6-[2-[3-(1,3-Benzodioxol-5-yl)-1-methylpropylidene]hydrazinyl]-1,2,4-triazine-3,5(2H,4H)-dione. Following Lipinski's Rule of Five, 6-[2-[3-(1,3-Benzodioxol-5-yl)-1-methylpropylidene]hydrazinyl]-1,2,4-triazine-3,5(2H,4H)-dione has 3 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 6-[2-[3-(1,3-Benzodioxol-5-yl)-1-methylpropylidene]hydrazinyl]-1,2,4-triazine-3,5(2H,4H)-dione?
The CAS number of 6-[2-[3-(1,3-Benzodioxol-5-yl)-1-methylpropylidene]hydrazinyl]-1,2,4-triazine-3,5(2H,4H)-dione is 380436-77-1.
What is the molecular formula of 6-[2-[3-(1,3-Benzodioxol-5-yl)-1-methylpropylidene]hydrazinyl]-1,2,4-triazine-3,5(2H,4H)-dione?
The molecular formula of 6-[2-[3-(1,3-Benzodioxol-5-yl)-1-methylpropylidene]hydrazinyl]-1,2,4-triazine-3,5(2H,4H)-dione is C14H15N5O4.
What is the molecular weight of 6-[2-[3-(1,3-Benzodioxol-5-yl)-1-methylpropylidene]hydrazinyl]-1,2,4-triazine-3,5(2H,4H)-dione?
The molecular weight of 6-[2-[3-(1,3-Benzodioxol-5-yl)-1-methylpropylidene]hydrazinyl]-1,2,4-triazine-3,5(2H,4H)-dione is 317.11 g/mol.
Where can I buy 6-[2-[3-(1,3-Benzodioxol-5-yl)-1-methylpropylidene]hydrazinyl]-1,2,4-triazine-3,5(2H,4H)-dione?
You can request a quote for 6-[2-[3-(1,3-Benzodioxol-5-yl)-1-methylpropylidene]hydrazinyl]-1,2,4-triazine-3,5(2H,4H)-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-[2-[3-(1,3-Benzodioxol-5-yl)-1-methylpropylidene]hydrazinyl]-1,2,4-triazine-3,5(2H,4H)-dione?
Yes, KEHONG BIO provides custom synthesis services for 6-[2-[3-(1,3-Benzodioxol-5-yl)-1-methylpropylidene]hydrazinyl]-1,2,4-triazine-3,5(2H,4H)-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.