![(7Z)-3-(1,3-benzodioxol-5-yl)-7-[(3-nitrophenyl)methylidene]-2,4-dihydro-[1,3]thiazolo[3,2-a][1,3,5]triazin-6-one structure](/static/products/3805/380582-06-9.webp)
(7Z)-3-(1,3-benzodioxol-5-yl)-7-[(3-nitrophenyl)methylidene]-2,4-dihydro-[1,3]thiazolo[3,2-a][1,3,5]triazin-6-one
TL;DR: (7Z)-3-(1,3-benzodioxol-5-yl)-7-[(3-nitrophenyl)methylidene]-2,4-dihydro-[1,3]thiazolo[3,2-a][1,3,5]triazin-6-one (CAS 380582-06-9) is a chemical compound with molecular formula C19H14N4O5S and molecular weight 410.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(7Z)-3-(1,3-benzodioxol-5-yl)-7-[(3-nitrophenyl)methylidene]-2,4-dihydro-[1,3]thiazolo[3,2-a][1,3,5]triazin-6-one
Also Known As: (7Z)-3-(1,3-benzodioxol-5-yl)-7-[(3-nitrophenyl)methylidene]-2,4-dihydro-[1,3]thiazolo[3,2-a][1,3,5]triazin-6-one, (Z)-3-(benzo[d][1,3]dioxol-5-yl)-7-(3-nitrobenzylidene)-3,4-dihydro-2H-thiazolo[3,2-a][1,3,5]triazin-6(7H)-one, (7Z)-3-(1,3-benzodioxol-5-yl)-7-(3-nitrobenzylidene)-3,4-dihydro-2H-[1,3]thiazolo[3,2-a][1,3,5]triazin-6(7H)-one, (7Z)-3-(2H-1,3-BENZODIOXOL-5-YL)-7-[(3-NITROPHENYL)METHYLIDENE]-2H,3H,4H,6H,7H-[1,3]THIAZOLO[3,2-A][1,3,5]TRIAZIN-6-ONE, 3-(1,3-benzodioxol-5-yl)-7-(3-nitrobenzylidene)-3,4-dihydro-2H-[1,3]thiazolo[3,2-a][1,3,5]triazin-6(7H)-one
| Molecular Formula | C19H14N4O5S |
|---|---|
| Molecular Weight | 410.07 g/mol |
| LogP | 1.4303 |
| Topological Polar Surface Area | 99.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 3 |
| Exact Mass | 410.06848 |
| Heavy Atoms | 29 |
| Complexity | 1312.8641 |
Chemical Identifiers
| CAS Number | 380582-06-9 |
|---|---|
| SMILES | C1N=C2N(CN1C3=CC4=C(C=C3)OCO4)C(=O)/C(=C/C5=CC(=CC=C5)[N+](=O)[O-])/S2 |
Product Overview
(7Z)-3-(1,3-benzodioxol-5-yl)-7-[(3-nitrophenyl)methylidene]-2,4-dihydro-[1,3]thiazolo[3,2-a][1,3,5]triazin-6-one (CAS 380582-06-9), with molecular formula C19H14N4O5S and molecular weight 410.07 g/mol. IUPAC: (7Z)-3-(1,3-benzodioxol-5-yl)-7-[(3-nitrophenyl)methylidene]-2,4-dihydro-[1,3]thiazolo[3,2-a][1,3,5]triazin-6-one.
Chemical Property Profile of (7Z)-3-(1,3-benzodioxol-5-yl)-7-[(3-nitrophenyl)methylidene]-2,4-dihydro-[1,3]thiazolo[3,2-a][1,3,5]triazin-6-one
Property Insights of (7Z)-3-(1,3-benzodioxol-5-yl)-7-[(3-nitrophenyl)methylidene]-2,4-dihydro-[1,3]thiazolo[3,2-a][1,3,5]triazin-6-one
The XLogP value of 1.4303 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (7Z)-3-(1,3-benzodioxol-5-yl)-7-[(3-nitrophenyl)methylidene]-2,4-dihydro-[1,3]thiazolo[3,2-a][1,3,5]triazin-6-one. The TPSA of 99.2 Ų falls within the moderate polarity range, balancing permeability and solubility for (7Z)-3-(1,3-benzodioxol-5-yl)-7-[(3-nitrophenyl)methylidene]-2,4-dihydro-[1,3]thiazolo[3,2-a][1,3,5]triazin-6-one. Following Lipinski's Rule of Five, (7Z)-3-(1,3-benzodioxol-5-yl)-7-[(3-nitrophenyl)methylidene]-2,4-dihydro-[1,3]thiazolo[3,2-a][1,3,5]triazin-6-one has 0 hydrogen bond donor(s) and 8 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 (7Z)-3-(1,3-benzodioxol-5-yl)-7-[(3-nitrophenyl)methylidene]-2,4-dihydro-[1,3]thiazolo[3,2-a][1,3,5]triazin-6-one?
The CAS number of (7Z)-3-(1,3-benzodioxol-5-yl)-7-[(3-nitrophenyl)methylidene]-2,4-dihydro-[1,3]thiazolo[3,2-a][1,3,5]triazin-6-one is 380582-06-9.
What is the molecular formula of (7Z)-3-(1,3-benzodioxol-5-yl)-7-[(3-nitrophenyl)methylidene]-2,4-dihydro-[1,3]thiazolo[3,2-a][1,3,5]triazin-6-one?
The molecular formula of (7Z)-3-(1,3-benzodioxol-5-yl)-7-[(3-nitrophenyl)methylidene]-2,4-dihydro-[1,3]thiazolo[3,2-a][1,3,5]triazin-6-one is C19H14N4O5S.
What is the molecular weight of (7Z)-3-(1,3-benzodioxol-5-yl)-7-[(3-nitrophenyl)methylidene]-2,4-dihydro-[1,3]thiazolo[3,2-a][1,3,5]triazin-6-one?
The molecular weight of (7Z)-3-(1,3-benzodioxol-5-yl)-7-[(3-nitrophenyl)methylidene]-2,4-dihydro-[1,3]thiazolo[3,2-a][1,3,5]triazin-6-one is 410.07 g/mol.
Where can I buy (7Z)-3-(1,3-benzodioxol-5-yl)-7-[(3-nitrophenyl)methylidene]-2,4-dihydro-[1,3]thiazolo[3,2-a][1,3,5]triazin-6-one?
You can request a quote for (7Z)-3-(1,3-benzodioxol-5-yl)-7-[(3-nitrophenyl)methylidene]-2,4-dihydro-[1,3]thiazolo[3,2-a][1,3,5]triazin-6-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (7Z)-3-(1,3-benzodioxol-5-yl)-7-[(3-nitrophenyl)methylidene]-2,4-dihydro-[1,3]thiazolo[3,2-a][1,3,5]triazin-6-one?
Yes, KEHONG BIO provides custom synthesis services for (7Z)-3-(1,3-benzodioxol-5-yl)-7-[(3-nitrophenyl)methylidene]-2,4-dihydro-[1,3]thiazolo[3,2-a][1,3,5]triazin-6-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.