C12H15N3OS2
TL;DR: C12H15N3OS2 (CAS 306966-92-7) is a chemical compound with molecular formula C12H15N3OS2 and molecular weight 281.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
12,12-dimethyl-5-methylsulfanyl-11-oxa-8-thia-4,6-diazatricyclo[7.4.0.02,7]trideca-1(9),2,4,6-tetraen-3-amine
Also Known As: 6,6-dimethyl-2-(methylsulfanyl)-5,8-dihydro-6H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-amine, 6,6-dimethyl-2-(methylthio)-6,8-dihydro-5H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-amine
| Molecular Formula | C12H15N3OS2 |
|---|---|
| Molecular Weight | 281.07 g/mol |
| LogP | 2.8467 |
| Topological Polar Surface Area | 61.03 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 1 |
| Exact Mass | 281.06564 |
| Heavy Atoms | 18 |
| Complexity | 621.3003 |
Chemical Identifiers
| CAS Number | 306966-92-7 |
|---|---|
| SMILES | CC1(CC2=C(CO1)SC3=NC(=NC(=C23)N)SC)C |
Product Overview
C12H15N3OS2 (CAS 306966-92-7), with molecular formula C12H15N3OS2 and molecular weight 281.07 g/mol. IUPAC: 12,12-dimethyl-5-methylsulfanyl-11-oxa-8-thia-4,6-diazatricyclo[7.4.0.02,7]trideca-1(9),2,4,6-tetraen-3-amine.
Chemical Property Profile of C12H15N3OS2
Property Insights of C12H15N3OS2
The XLogP value of 2.8467 suggests moderate lipophilicity, balancing water solubility and membrane permeability for C12H15N3OS2. The TPSA of 61.03 Ų falls within the moderate polarity range, balancing permeability and solubility for C12H15N3OS2. Following Lipinski's Rule of Five, C12H15N3OS2 has 1 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 C12H15N3OS2?
The CAS number of C12H15N3OS2 is 306966-92-7.
What is the molecular formula of C12H15N3OS2?
The molecular formula of C12H15N3OS2 is C12H15N3OS2.
What is the molecular weight of C12H15N3OS2?
The molecular weight of C12H15N3OS2 is 281.07 g/mol.
Where can I buy C12H15N3OS2?
You can request a quote for C12H15N3OS2 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for C12H15N3OS2?
Yes, KEHONG BIO provides custom synthesis services for C12H15N3OS2 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.