(5Z)-5-(1H-benzimidazol-2-ylmethylidene)-1-(4-methoxyphenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione
TL;DR: (5Z)-5-(1H-benzimidazol-2-ylmethylidene)-1-(4-methoxyphenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione (CAS 373374-06-2) is a chemical compound with molecular formula C19H14N4O3S and molecular weight 378.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-(benzimidazol-2-ylidenemethyl)-6-hydroxy-1-(4-methoxyphenyl)-2-sulfanylidenepyrimidin-4-one
Also Known As: (5Z)-5-(1H-benzimidazol-2-ylmethylidene)-1-(4-methoxyphenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione, (5Z)-5-(1H-benzimidazol-2-ylmethylidene)-1-(4-methoxyphenyl)-2-sulfanylpyrimidine-4,6(1H,5H)-dione, (Z)-5-((1H-benzo[d]imidazol-2-yl)methylene)-1-(4-methoxyphenyl)-2-thioxodihydropyrimidine-4,6(1H,5H)-dione, 5-(1H-benzimidazol-2-ylmethylidene)-1-(4-methoxyphenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione
| Molecular Formula | C19H14N4O3S |
|---|---|
| Molecular Weight | 378.08 g/mol |
| LogP | 1.86069 |
| Topological Polar Surface Area | 91.97 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 378.07867 |
| Heavy Atoms | 27 |
| Complexity | 1267.5071 |
Chemical Identifiers
| CAS Number | 373374-06-2 |
|---|---|
| SMILES | COC1=CC=C(C=C1)N2C(=C(C(=O)NC2=S)C=C3N=C4C=CC=CC4=N3)O |
Product Overview
(5Z)-5-(1H-benzimidazol-2-ylmethylidene)-1-(4-methoxyphenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione (CAS 373374-06-2), with molecular formula C19H14N4O3S and molecular weight 378.08 g/mol. IUPAC: 5-(benzimidazol-2-ylidenemethyl)-6-hydroxy-1-(4-methoxyphenyl)-2-sulfanylidenepyrimidin-4-one.
Chemical Property Profile of (5Z)-5-(1H-benzimidazol-2-ylmethylidene)-1-(4-methoxyphenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione
Property Insights of (5Z)-5-(1H-benzimidazol-2-ylmethylidene)-1-(4-methoxyphenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione
The XLogP value of 1.86069 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (5Z)-5-(1H-benzimidazol-2-ylmethylidene)-1-(4-methoxyphenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione. The TPSA of 91.97 Ų falls within the moderate polarity range, balancing permeability and solubility for (5Z)-5-(1H-benzimidazol-2-ylmethylidene)-1-(4-methoxyphenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione. Following Lipinski's Rule of Five, (5Z)-5-(1H-benzimidazol-2-ylmethylidene)-1-(4-methoxyphenyl)-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)-5-(1H-benzimidazol-2-ylmethylidene)-1-(4-methoxyphenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione?
The CAS number of (5Z)-5-(1H-benzimidazol-2-ylmethylidene)-1-(4-methoxyphenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione is 373374-06-2.
What is the molecular formula of (5Z)-5-(1H-benzimidazol-2-ylmethylidene)-1-(4-methoxyphenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione?
The molecular formula of (5Z)-5-(1H-benzimidazol-2-ylmethylidene)-1-(4-methoxyphenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione is C19H14N4O3S.
What is the molecular weight of (5Z)-5-(1H-benzimidazol-2-ylmethylidene)-1-(4-methoxyphenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione?
The molecular weight of (5Z)-5-(1H-benzimidazol-2-ylmethylidene)-1-(4-methoxyphenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione is 378.08 g/mol.
Where can I buy (5Z)-5-(1H-benzimidazol-2-ylmethylidene)-1-(4-methoxyphenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione?
You can request a quote for (5Z)-5-(1H-benzimidazol-2-ylmethylidene)-1-(4-methoxyphenyl)-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)-5-(1H-benzimidazol-2-ylmethylidene)-1-(4-methoxyphenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione?
Yes, KEHONG BIO provides custom synthesis services for (5Z)-5-(1H-benzimidazol-2-ylmethylidene)-1-(4-methoxyphenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.