Cambridge id 6644173
TL;DR: Cambridge id 6644173 (CAS 430471-89-9) is a chemical compound with molecular formula C19H18N4OS2 and molecular weight 382.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4,5-dimethyl-12-(2-methylprop-2-enylsulfanyl)-8-phenyl-3-thia-1,8,10,11-tetrazatricyclo[7.3.0.02,6]dodeca-2(6),4,9,11-tetraen-7-one
Also Known As: AJ-292/14559258, 2,3-dimethyl-8-((2-methylallyl)thio)-5-phenylthieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-4(5H)-one, 2,3-dimethyl-8-[(2-methyl-2-propenyl)sulfanyl]-5-phenylthieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-4(5H)-one, 4,5-dimethyl-12-(2-methylprop-2-enylsulfanyl)-8-phenyl-3-thia-1,8,10,11-tetrazatricyclo[7.3.0.02,6]dodeca-2(6),4,9,11-tetraen-7-one, 6,7-dimethyl-1-(2-methylprop-2-enylthio)-4-phenyl-4,9-dihydrothiopheno[3,2-e]1 ,2,4-triazolo[4,3-a]pyrimidin-5-one
| Molecular Formula | C19H18N4OS2 |
|---|---|
| Molecular Weight | 382.09 g/mol |
| LogP | 4.37994 |
| Topological Polar Surface Area | 52.19 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 382.0922 |
| Heavy Atoms | 26 |
| Complexity | 1201.4515 |
Chemical Identifiers
| CAS Number | 430471-89-9 |
|---|---|
| SMILES | CC1=C(SC2=C1C(=O)N(C3=NN=C(N23)SCC(=C)C)C4=CC=CC=C4)C |
Product Overview
Cambridge id 6644173 (CAS 430471-89-9), with molecular formula C19H18N4OS2 and molecular weight 382.09 g/mol. IUPAC: 4,5-dimethyl-12-(2-methylprop-2-enylsulfanyl)-8-phenyl-3-thia-1,8,10,11-tetrazatricyclo[7.3.0.02,6]dodeca-2(6),4,9,11-tetraen-7-one.
Chemical Property Profile of Cambridge id 6644173
Property Insights of Cambridge id 6644173
The XLogP value of 4.37994 indicates that Cambridge id 6644173 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.19 Ų, Cambridge id 6644173 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Cambridge id 6644173 has 0 hydrogen bond donor(s) and 5 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 Cambridge id 6644173?
The CAS number of Cambridge id 6644173 is 430471-89-9.
What is the molecular formula of Cambridge id 6644173?
The molecular formula of Cambridge id 6644173 is C19H18N4OS2.
What is the molecular weight of Cambridge id 6644173?
The molecular weight of Cambridge id 6644173 is 382.09 g/mol.
Where can I buy Cambridge id 6644173?
You can request a quote for Cambridge id 6644173 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Cambridge id 6644173?
Yes, KEHONG BIO provides custom synthesis services for Cambridge id 6644173 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.