![(5Z)-1-cyclopropyl-5-[(2,5-dimethoxyanilino)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione structure](/static/products/714/714254-86-1.png)
(5Z)-1-cyclopropyl-5-[(2,5-dimethoxyanilino)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione
TL;DR: (5Z)-1-cyclopropyl-5-[(2,5-dimethoxyanilino)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione (CAS 714254-86-1) is a chemical compound with molecular formula C16H17N3O4S and molecular weight 347.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-cyclopropyl-5-[(2,5-dimethoxyphenyl)iminomethyl]-6-hydroxy-2-sulfanylidenepyrimidin-4-one
Also Known As: (5Z)-1-cyclopropyl-5-[(2,5-dimethoxyanilino)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione, (5Z)-1-cyclopropyl-5-{[(2,5-dimethoxyphenyl)amino]methylidene}-2-sulfanylpyrimidine-4,6(1H,5H)-dione, (Z)-1-cyclopropyl-5-(((2,5-dimethoxyphenyl)amino)methylene)-2-thioxodihydropyrimidine-4,6(1H,5H)-dione, 1-cyclopropyl-5-[(2,5-dimethoxyanilino)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione
| Molecular Formula | C16H17N3O4S |
|---|---|
| Molecular Weight | 347.09 g/mol |
| LogP | 2.71419 |
| Topological Polar Surface Area | 88.84 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 347.09396 |
| Heavy Atoms | 24 |
| Complexity | 912.51416 |
Chemical Identifiers
| CAS Number | 714254-86-1 |
|---|---|
| SMILES | COC1=CC(=C(C=C1)OC)N=CC2=C(N(C(=S)NC2=O)C3CC3)O |
Product Overview
(5Z)-1-cyclopropyl-5-[(2,5-dimethoxyanilino)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione (CAS 714254-86-1), with molecular formula C16H17N3O4S and molecular weight 347.09 g/mol. IUPAC: 1-cyclopropyl-5-[(2,5-dimethoxyphenyl)iminomethyl]-6-hydroxy-2-sulfanylidenepyrimidin-4-one.
Chemical Property Profile of (5Z)-1-cyclopropyl-5-[(2,5-dimethoxyanilino)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione
Property Insights of (5Z)-1-cyclopropyl-5-[(2,5-dimethoxyanilino)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione
The XLogP value of 2.71419 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (5Z)-1-cyclopropyl-5-[(2,5-dimethoxyanilino)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione. The TPSA of 88.84 Ų falls within the moderate polarity range, balancing permeability and solubility for (5Z)-1-cyclopropyl-5-[(2,5-dimethoxyanilino)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione. Following Lipinski's Rule of Five, (5Z)-1-cyclopropyl-5-[(2,5-dimethoxyanilino)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione has 2 hydrogen bond donor(s) and 6 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 (5Z)-1-cyclopropyl-5-[(2,5-dimethoxyanilino)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione?
The CAS number of (5Z)-1-cyclopropyl-5-[(2,5-dimethoxyanilino)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione is 714254-86-1.
What is the molecular formula of (5Z)-1-cyclopropyl-5-[(2,5-dimethoxyanilino)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione?
The molecular formula of (5Z)-1-cyclopropyl-5-[(2,5-dimethoxyanilino)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione is C16H17N3O4S.
What is the molecular weight of (5Z)-1-cyclopropyl-5-[(2,5-dimethoxyanilino)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione?
The molecular weight of (5Z)-1-cyclopropyl-5-[(2,5-dimethoxyanilino)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione is 347.09 g/mol.
Where can I buy (5Z)-1-cyclopropyl-5-[(2,5-dimethoxyanilino)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione?
You can request a quote for (5Z)-1-cyclopropyl-5-[(2,5-dimethoxyanilino)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (5Z)-1-cyclopropyl-5-[(2,5-dimethoxyanilino)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione?
Yes, KEHONG BIO provides custom synthesis services for (5Z)-1-cyclopropyl-5-[(2,5-dimethoxyanilino)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.