4-Pyrimidinamine, 2,2'-(1,3-propanediylbis(thio))bis-
TL;DR: 4-Pyrimidinamine, 2,2'-(1,3-propanediylbis(thio))bis- (CAS 123392-12-1) is a chemical compound with molecular formula C11H14N6S2 and molecular weight 294.07214 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-[3-(4-aminopyrimidin-2-yl)sulfanylpropylsulfanyl]pyrimidin-4-amine
Also Known As: 1,3-Bis(4-aminopyrimidinyl-2-thio)propane, 4-Pyrimidinamine, 2,2'-(1,3-propanediylbis(thio))bis-, 2,2'-(1,3-Propanediylbis(thio))bis(4-pyrimidinamine), 2,2'-[Propane-1,3-diylbis(sulfanediyl)]di(pyrimidin-4-amine), 2-[3-(4-aminopyrimidin-2-yl)sulfanylpropylsulfanyl]pyrimidin-4-amine
Technical Specifications
| Molecular Formula | C11H14N6S2 |
| Molecular Weight | 294.07214 g/mol |
| XLogP | 1.5 |
| Topological Polar Surface Area (TPSA) | 154.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 6 |
| Exact Mass | 294.07214 Da |
| Heavy Atoms | 19 |
| Complexity | 233.0 |
| SMILES | C1=CN=C(N=C1N)SCCCSC2=NC=CC(=N2)N |
| InChIKey | VKOJMFASCCFCKW-UHFFFAOYSA-N |
Chemical Property Profile of 4-Pyrimidinamine, 2,2'-(1,3-propanediylbis(thio))bis-
Property Insights of 4-Pyrimidinamine, 2,2'-(1,3-propanediylbis(thio))bis-
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Pyrimidinamine, 2,2'-(1,3-propanediylbis(thio))bis-. The TPSA of 154.0 Ų indicates high polarity, suggesting 4-Pyrimidinamine, 2,2'-(1,3-propanediylbis(thio))bis- may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 4-Pyrimidinamine, 2,2'-(1,3-propanediylbis(thio))bis- has 2 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 4-Pyrimidinamine, 2,2'-(1,3-propanediylbis(thio))bis-?
The CAS number of 4-Pyrimidinamine, 2,2'-(1,3-propanediylbis(thio))bis- is 123392-12-1.
What is the molecular formula of 4-Pyrimidinamine, 2,2'-(1,3-propanediylbis(thio))bis-?
The molecular formula of 4-Pyrimidinamine, 2,2'-(1,3-propanediylbis(thio))bis- is C11H14N6S2.
What is the molecular weight of 4-Pyrimidinamine, 2,2'-(1,3-propanediylbis(thio))bis-?
The molecular weight of 4-Pyrimidinamine, 2,2'-(1,3-propanediylbis(thio))bis- is 294.07214 g/mol.
Where can I buy 4-Pyrimidinamine, 2,2'-(1,3-propanediylbis(thio))bis-?
You can request a quote for 4-Pyrimidinamine, 2,2'-(1,3-propanediylbis(thio))bis- directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 4-Pyrimidinamine, 2,2'-(1,3-propanediylbis(thio))bis-?
Yes, CoreyChem provides custom synthesis services for 4-Pyrimidinamine, 2,2'-(1,3-propanediylbis(thio))bis- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.