6-amino-5-(1,3-benzothiazol-2-ylsulfanyl)-4-hydroxy-1-methylpyrimidin-2(1H)-one
TL;DR: 6-amino-5-(1,3-benzothiazol-2-ylsulfanyl)-4-hydroxy-1-methylpyrimidin-2(1H)-one (CAS 874754-01-5) is a chemical compound with molecular formula C12H10N4O2S2 and molecular weight 306.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-amino-5-(1,3-benzothiazol-2-ylsulfanyl)-1-methylpyrimidine-2,4-dione
Also Known As: BAS 10258613, BRD-K76298614-001-01-0, 6-amino-5-(1,3-benzothiazol-2-ylsulfanyl)-4-hydroxy-1-methylpyrimidin-2(1H)-one, 6-amino-5-(1,3-benzothiazol-2-ylsulfanyl)-1-methylpyrimidine-2,4-dione, 6-amino-5-(benzo[d]thiazol-2-ylthio)-1-methylpyrimidine-2,4(1H,3H)-dione
| Molecular Formula | C12H10N4O2S2 |
|---|---|
| Molecular Weight | 306.02 g/mol |
| LogP | 1.4167 |
| Topological Polar Surface Area | 93.77 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 306.0245 |
| Heavy Atoms | 20 |
| Complexity | 876.6967 |
Chemical Identifiers
| CAS Number | 874754-01-5 |
|---|---|
| SMILES | CN1C(=C(C(=O)NC1=O)SC2=NC3=CC=CC=C3S2)N |
Product Overview
6-amino-5-(1,3-benzothiazol-2-ylsulfanyl)-4-hydroxy-1-methylpyrimidin-2(1H)-one (CAS 874754-01-5), with molecular formula C12H10N4O2S2 and molecular weight 306.02 g/mol. IUPAC: 6-amino-5-(1,3-benzothiazol-2-ylsulfanyl)-1-methylpyrimidine-2,4-dione.
Chemical Property Profile of 6-amino-5-(1,3-benzothiazol-2-ylsulfanyl)-4-hydroxy-1-methylpyrimidin-2(1H)-one
Property Insights of 6-amino-5-(1,3-benzothiazol-2-ylsulfanyl)-4-hydroxy-1-methylpyrimidin-2(1H)-one
The XLogP value of 1.4167 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6-amino-5-(1,3-benzothiazol-2-ylsulfanyl)-4-hydroxy-1-methylpyrimidin-2(1H)-one. The TPSA of 93.77 Ų falls within the moderate polarity range, balancing permeability and solubility for 6-amino-5-(1,3-benzothiazol-2-ylsulfanyl)-4-hydroxy-1-methylpyrimidin-2(1H)-one. Following Lipinski's Rule of Five, 6-amino-5-(1,3-benzothiazol-2-ylsulfanyl)-4-hydroxy-1-methylpyrimidin-2(1H)-one 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 6-amino-5-(1,3-benzothiazol-2-ylsulfanyl)-4-hydroxy-1-methylpyrimidin-2(1H)-one?
The CAS number of 6-amino-5-(1,3-benzothiazol-2-ylsulfanyl)-4-hydroxy-1-methylpyrimidin-2(1H)-one is 874754-01-5.
What is the molecular formula of 6-amino-5-(1,3-benzothiazol-2-ylsulfanyl)-4-hydroxy-1-methylpyrimidin-2(1H)-one?
The molecular formula of 6-amino-5-(1,3-benzothiazol-2-ylsulfanyl)-4-hydroxy-1-methylpyrimidin-2(1H)-one is C12H10N4O2S2.
What is the molecular weight of 6-amino-5-(1,3-benzothiazol-2-ylsulfanyl)-4-hydroxy-1-methylpyrimidin-2(1H)-one?
The molecular weight of 6-amino-5-(1,3-benzothiazol-2-ylsulfanyl)-4-hydroxy-1-methylpyrimidin-2(1H)-one is 306.02 g/mol.
Where can I buy 6-amino-5-(1,3-benzothiazol-2-ylsulfanyl)-4-hydroxy-1-methylpyrimidin-2(1H)-one?
You can request a quote for 6-amino-5-(1,3-benzothiazol-2-ylsulfanyl)-4-hydroxy-1-methylpyrimidin-2(1H)-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-amino-5-(1,3-benzothiazol-2-ylsulfanyl)-4-hydroxy-1-methylpyrimidin-2(1H)-one?
Yes, KEHONG BIO provides custom synthesis services for 6-amino-5-(1,3-benzothiazol-2-ylsulfanyl)-4-hydroxy-1-methylpyrimidin-2(1H)-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.