![6-hydroxy-5-[(6-methyl-1,3-benzothiazol-2-yl)iminomethyl]-2-sulfanylidene-1H-pyrimidin-4-one structure](/static/products/330/330471-83-5.png)
6-hydroxy-5-[(6-methyl-1,3-benzothiazol-2-yl)iminomethyl]-2-sulfanylidene-1H-pyrimidin-4-one
TL;DR: 6-hydroxy-5-[(6-methyl-1,3-benzothiazol-2-yl)iminomethyl]-2-sulfanylidene-1H-pyrimidin-4-one (CAS 330471-83-5) is a chemical compound with molecular formula C13H10N4O2S2 and molecular weight 318.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-hydroxy-5-[(6-methyl-1,3-benzothiazol-2-yl)iminomethyl]-2-sulfanylidene-1H-pyrimidin-4-one
Also Known As: 5-{[(6-methyl-1,3-benzothiazol-2-yl)amino]methylidene}-2-sulfanylidene-1,3-diazinane-4,6-dione
| Molecular Formula | C13H10N4O2S2 |
|---|---|
| Molecular Weight | 318.02 g/mol |
| LogP | 2.80681 |
| Topological Polar Surface Area | 94.13 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 318.0245 |
| Heavy Atoms | 21 |
| Complexity | 968.1971 |
Chemical Identifiers
| CAS Number | 330471-83-5 |
|---|---|
| SMILES | CC1=CC2=C(C=C1)N=C(S2)N=CC3=C(NC(=S)NC3=O)O |
Product Overview
6-hydroxy-5-[(6-methyl-1,3-benzothiazol-2-yl)iminomethyl]-2-sulfanylidene-1H-pyrimidin-4-one (CAS 330471-83-5), with molecular formula C13H10N4O2S2 and molecular weight 318.02 g/mol. IUPAC: 6-hydroxy-5-[(6-methyl-1,3-benzothiazol-2-yl)iminomethyl]-2-sulfanylidene-1H-pyrimidin-4-one.
Chemical Property Profile of 6-hydroxy-5-[(6-methyl-1,3-benzothiazol-2-yl)iminomethyl]-2-sulfanylidene-1H-pyrimidin-4-one
Property Insights of 6-hydroxy-5-[(6-methyl-1,3-benzothiazol-2-yl)iminomethyl]-2-sulfanylidene-1H-pyrimidin-4-one
The XLogP value of 2.80681 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6-hydroxy-5-[(6-methyl-1,3-benzothiazol-2-yl)iminomethyl]-2-sulfanylidene-1H-pyrimidin-4-one. The TPSA of 94.13 Ų falls within the moderate polarity range, balancing permeability and solubility for 6-hydroxy-5-[(6-methyl-1,3-benzothiazol-2-yl)iminomethyl]-2-sulfanylidene-1H-pyrimidin-4-one. Following Lipinski's Rule of Five, 6-hydroxy-5-[(6-methyl-1,3-benzothiazol-2-yl)iminomethyl]-2-sulfanylidene-1H-pyrimidin-4-one has 3 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 6-hydroxy-5-[(6-methyl-1,3-benzothiazol-2-yl)iminomethyl]-2-sulfanylidene-1H-pyrimidin-4-one?
The CAS number of 6-hydroxy-5-[(6-methyl-1,3-benzothiazol-2-yl)iminomethyl]-2-sulfanylidene-1H-pyrimidin-4-one is 330471-83-5.
What is the molecular formula of 6-hydroxy-5-[(6-methyl-1,3-benzothiazol-2-yl)iminomethyl]-2-sulfanylidene-1H-pyrimidin-4-one?
The molecular formula of 6-hydroxy-5-[(6-methyl-1,3-benzothiazol-2-yl)iminomethyl]-2-sulfanylidene-1H-pyrimidin-4-one is C13H10N4O2S2.
What is the molecular weight of 6-hydroxy-5-[(6-methyl-1,3-benzothiazol-2-yl)iminomethyl]-2-sulfanylidene-1H-pyrimidin-4-one?
The molecular weight of 6-hydroxy-5-[(6-methyl-1,3-benzothiazol-2-yl)iminomethyl]-2-sulfanylidene-1H-pyrimidin-4-one is 318.02 g/mol.
Where can I buy 6-hydroxy-5-[(6-methyl-1,3-benzothiazol-2-yl)iminomethyl]-2-sulfanylidene-1H-pyrimidin-4-one?
You can request a quote for 6-hydroxy-5-[(6-methyl-1,3-benzothiazol-2-yl)iminomethyl]-2-sulfanylidene-1H-pyrimidin-4-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-hydroxy-5-[(6-methyl-1,3-benzothiazol-2-yl)iminomethyl]-2-sulfanylidene-1H-pyrimidin-4-one?
Yes, KEHONG BIO provides custom synthesis services for 6-hydroxy-5-[(6-methyl-1,3-benzothiazol-2-yl)iminomethyl]-2-sulfanylidene-1H-pyrimidin-4-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.