VU0509255-1
TL;DR: VU0509255-1 (CAS 883276-10-6) is a chemical compound with molecular formula C13H13N5OS2 and molecular weight 319.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-methyl-5-(4-methyl-5-sulfanylidene-1H-1,2,4-triazol-3-yl)-6-thia-1,8-diazatricyclo[7.3.0.03,7]dodeca-3(7),4,8-trien-2-one
Also Known As: VU0509255-1, AB00682626-01, F3102-0005, 3-methyl-2-(4-methyl-5-thioxo-4,5-dihydro-1H-1,2,4-triazol-3-yl)-7,8-dihydropyrrolo[1,2-a]thieno[2,3-d]pyrimidin-4(6H)-one, 4-methyl-5-(4-methyl-5-sulfanylidene-4,5-dihydro-1H-1,2,4-triazol-3-yl)-6-thia-1,8-diazatricyclo[7.3.0.0^{3,7}]dodeca-3(7),4,8-trien-2-one
| Molecular Formula | C13H13N5OS2 |
|---|---|
| Molecular Weight | 319.06 g/mol |
| LogP | 2.17071 |
| Topological Polar Surface Area | 68.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 1 |
| Exact Mass | 319.05615 |
| Heavy Atoms | 21 |
| Complexity | 990.55365 |
Chemical Identifiers
| CAS Number | 883276-10-6 |
|---|---|
| SMILES | CC1=C(SC2=C1C(=O)N3CCCC3=N2)C4=NNC(=S)N4C |
Product Overview
VU0509255-1 (CAS 883276-10-6), with molecular formula C13H13N5OS2 and molecular weight 319.06 g/mol. IUPAC: 4-methyl-5-(4-methyl-5-sulfanylidene-1H-1,2,4-triazol-3-yl)-6-thia-1,8-diazatricyclo[7.3.0.03,7]dodeca-3(7),4,8-trien-2-one.
Chemical Property Profile of VU0509255-1
Property Insights of VU0509255-1
The XLogP value of 2.17071 suggests moderate lipophilicity, balancing water solubility and membrane permeability for VU0509255-1. The TPSA of 68.5 Ų falls within the moderate polarity range, balancing permeability and solubility for VU0509255-1. Following Lipinski's Rule of Five, VU0509255-1 has 1 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 VU0509255-1?
The CAS number of VU0509255-1 is 883276-10-6.
What is the molecular formula of VU0509255-1?
The molecular formula of VU0509255-1 is C13H13N5OS2.
What is the molecular weight of VU0509255-1?
The molecular weight of VU0509255-1 is 319.06 g/mol.
Where can I buy VU0509255-1?
You can request a quote for VU0509255-1 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for VU0509255-1?
Yes, KEHONG BIO provides custom synthesis services for VU0509255-1 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.