C14H17N3O2S3
TL;DR: C14H17N3O2S3 (CAS 903591-07-1) is a chemical compound with molecular formula C14H17N3O2S3 and molecular weight 355.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(11,11-dimethyl-4-methylsulfanyl-12-oxa-8-thia-3,5-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5-tetraen-6-yl)sulfanyl]acetamide
Also Known As: 2-((7,7-dimethyl-2-(methylthio)-7,9-dihydro-6H-pyrano[3',4':4,5]thieno[3,2-d]pyrimidin-4-yl)thio)acetamide, 2-[(7,7-dimethyl-2-methylsulfanyl-6,9-dihydropyrano[2,3]thieno[2,4-b]pyrimidin-4-yl)sulfanyl]acetamide, 2-{[7,7-dimethyl-2-(methylsulfanyl)-6,9-dihydro-7H-pyrano[3',4':4,5]thieno[3,2-d]pyrimidin-4-yl]sulfanyl}acetamide
| Molecular Formula | C14H17N3O2S3 |
|---|---|
| Molecular Weight | 355.05 g/mol |
| LogP | 2.8419 |
| Topological Polar Surface Area | 78.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 355.04828 |
| Heavy Atoms | 22 |
| Complexity | 742.49854 |
Chemical Identifiers
| CAS Number | 903591-07-1 |
|---|---|
| SMILES | CC1(CC2=C(CO1)C3=C(S2)C(=NC(=N3)SC)SCC(=O)N)C |
Product Overview
C14H17N3O2S3 (CAS 903591-07-1), with molecular formula C14H17N3O2S3 and molecular weight 355.05 g/mol. IUPAC: 2-[(11,11-dimethyl-4-methylsulfanyl-12-oxa-8-thia-3,5-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5-tetraen-6-yl)sulfanyl]acetamide.
Chemical Property Profile of C14H17N3O2S3
Property Insights of C14H17N3O2S3
The XLogP value of 2.8419 suggests moderate lipophilicity, balancing water solubility and membrane permeability for C14H17N3O2S3. The TPSA of 78.1 Ų falls within the moderate polarity range, balancing permeability and solubility for C14H17N3O2S3. Following Lipinski's Rule of Five, C14H17N3O2S3 has 1 hydrogen bond donor(s) and 7 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 C14H17N3O2S3?
The CAS number of C14H17N3O2S3 is 903591-07-1.
What is the molecular formula of C14H17N3O2S3?
The molecular formula of C14H17N3O2S3 is C14H17N3O2S3.
What is the molecular weight of C14H17N3O2S3?
The molecular weight of C14H17N3O2S3 is 355.05 g/mol.
Where can I buy C14H17N3O2S3?
You can request a quote for C14H17N3O2S3 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for C14H17N3O2S3?
Yes, KEHONG BIO provides custom synthesis services for C14H17N3O2S3 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.