![12-phenyl-2-(thiophen-2-yl)-12H-chromeno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-9-ol structure](/static/products/844/844852-89-7.png)
12-phenyl-2-(thiophen-2-yl)-12H-chromeno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-9-ol
TL;DR: 12-phenyl-2-(thiophen-2-yl)-12H-chromeno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-9-ol (CAS 844852-89-7) is a chemical compound with molecular formula C22H14N4O2S and molecular weight 398.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
9-phenyl-13-thiophen-2-yl-2-oxa-12,14,15,17-tetrazatetracyclo[8.7.0.03,8.011,15]heptadeca-1(10),3(8),4,6,11,13,16-heptaen-5-ol
Also Known As: 12-phenyl-2-(thiophen-2-yl)-12H-chromeno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-9-ol, 12-phenyl-2-(thiophen-2-yl)-12H-chromeno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-3-ium-9-olate
| Molecular Formula | C22H14N4O2S |
|---|---|
| Molecular Weight | 398.08 g/mol |
| LogP | 4.8443 |
| Topological Polar Surface Area | 72.54 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 398.08374 |
| Heavy Atoms | 29 |
| Complexity | 1346.5353 |
Chemical Identifiers
| CAS Number | 844852-89-7 |
|---|---|
| SMILES | C1=CC=C(C=C1)C2C3=C(C=C(C=C3)O)OC4=C2C5=NC(=NN5C=N4)C6=CC=CS6 |
Product Overview
12-phenyl-2-(thiophen-2-yl)-12H-chromeno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-9-ol (CAS 844852-89-7), with molecular formula C22H14N4O2S and molecular weight 398.08 g/mol. IUPAC: 9-phenyl-13-thiophen-2-yl-2-oxa-12,14,15,17-tetrazatetracyclo[8.7.0.03,8.011,15]heptadeca-1(10),3(8),4,6,11,13,16-heptaen-5-ol.
Chemical Property Profile of 12-phenyl-2-(thiophen-2-yl)-12H-chromeno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-9-ol
Property Insights of 12-phenyl-2-(thiophen-2-yl)-12H-chromeno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-9-ol
The XLogP value of 4.8443 indicates that 12-phenyl-2-(thiophen-2-yl)-12H-chromeno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-9-ol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 72.54 Ų falls within the moderate polarity range, balancing permeability and solubility for 12-phenyl-2-(thiophen-2-yl)-12H-chromeno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-9-ol. Following Lipinski's Rule of Five, 12-phenyl-2-(thiophen-2-yl)-12H-chromeno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-9-ol 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 12-phenyl-2-(thiophen-2-yl)-12H-chromeno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-9-ol?
The CAS number of 12-phenyl-2-(thiophen-2-yl)-12H-chromeno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-9-ol is 844852-89-7.
What is the molecular formula of 12-phenyl-2-(thiophen-2-yl)-12H-chromeno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-9-ol?
The molecular formula of 12-phenyl-2-(thiophen-2-yl)-12H-chromeno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-9-ol is C22H14N4O2S.
What is the molecular weight of 12-phenyl-2-(thiophen-2-yl)-12H-chromeno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-9-ol?
The molecular weight of 12-phenyl-2-(thiophen-2-yl)-12H-chromeno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-9-ol is 398.08 g/mol.
Where can I buy 12-phenyl-2-(thiophen-2-yl)-12H-chromeno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-9-ol?
You can request a quote for 12-phenyl-2-(thiophen-2-yl)-12H-chromeno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-9-ol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 12-phenyl-2-(thiophen-2-yl)-12H-chromeno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-9-ol?
Yes, KEHONG BIO provides custom synthesis services for 12-phenyl-2-(thiophen-2-yl)-12H-chromeno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-9-ol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.