VU0101214-2
TL;DR: VU0101214-2 (CAS 892214-55-0) is a chemical compound with molecular formula C22H19N5O2S3 and molecular weight 481.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(12-oxo-11-prop-2-enyl-7-thia-9,11-diazatricyclo[6.4.0.02,6]dodeca-1(8),2(6),9-trien-10-yl)sulfanyl]-N-(3-phenyl-1,2,4-thiadiazol-5-yl)acetamide
Also Known As: VU0101214-2, F3394-1383, 2-{[12-oxo-11-(prop-2-en-1-yl)-7-thia-9,11-diazatricyclo[6.4.0.0^{2,6}]dodeca-1(8),2(6),9-trien-10-yl]sulfanyl}-N-(3-phenyl-1,2,4-thiadiazol-5-yl)acetamide, 2-((3-allyl-4-oxo-4,5,6,7-tetrahydro-3H-cyclopenta[4,5]thieno[2,3-d]pyrimidin-2-yl)thio)-N-(3-phenyl-1,2,4-thiadiazol-5-yl)acetamide, 2-[(12-oxo-11-prop-2-enyl-7-thia-9,11-diazatricyclo[6.4.0.02,6]dodeca-1(8),2(6),9-trien-10-yl)sulfanyl]-N-(3-phenyl-1,2,4-thiadiazol-5-yl)acetamide
| Molecular Formula | C22H19N5O2S3 |
|---|---|
| Molecular Weight | 481.07 g/mol |
| LogP | 4.382 |
| Topological Polar Surface Area | 89.77 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 7 |
| Exact Mass | 481.0701 |
| Heavy Atoms | 32 |
| Complexity | 1373.7281 |
Chemical Identifiers
| CAS Number | 892214-55-0 |
|---|---|
| SMILES | C=CCN1C(=O)C2=C(N=C1SCC(=O)NC3=NC(=NS3)C4=CC=CC=C4)SC5=C2CCC5 |
Product Overview
VU0101214-2 (CAS 892214-55-0), with molecular formula C22H19N5O2S3 and molecular weight 481.07 g/mol. IUPAC: 2-[(12-oxo-11-prop-2-enyl-7-thia-9,11-diazatricyclo[6.4.0.02,6]dodeca-1(8),2(6),9-trien-10-yl)sulfanyl]-N-(3-phenyl-1,2,4-thiadiazol-5-yl)acetamide.
Chemical Property Profile of VU0101214-2
Property Insights of VU0101214-2
The XLogP value of 4.382 indicates that VU0101214-2 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 89.77 Ų falls within the moderate polarity range, balancing permeability and solubility for VU0101214-2. Following Lipinski's Rule of Five, VU0101214-2 has 1 hydrogen bond donor(s) and 8 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 VU0101214-2?
The CAS number of VU0101214-2 is 892214-55-0.
What is the molecular formula of VU0101214-2?
The molecular formula of VU0101214-2 is C22H19N5O2S3.
What is the molecular weight of VU0101214-2?
The molecular weight of VU0101214-2 is 481.07 g/mol.
Where can I buy VU0101214-2?
You can request a quote for VU0101214-2 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for VU0101214-2?
Yes, KEHONG BIO provides custom synthesis services for VU0101214-2 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.