12-(3,4-dimethoxyphenyl)-2-[(naphthalen-2-yloxy)methyl]-12H-chromeno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-9-ol
TL;DR: 12-(3,4-dimethoxyphenyl)-2-[(naphthalen-2-yloxy)methyl]-12H-chromeno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-9-ol (CAS 848059-13-2) is a chemical compound with molecular formula C31H24N4O5 and molecular weight 532.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
9-(3,4-dimethoxyphenyl)-13-(naphthalen-2-yloxymethyl)-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-(3,4-dimethoxyphenyl)-2-[(naphthalen-2-yloxy)methyl]-12H-chromeno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-9-ol, 12-(3,4-dimethoxyphenyl)-2-((naphthalen-2-yloxy)methyl)-12H-chromeno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-9-ol
| Molecular Formula | C31H24N4O5 |
|---|---|
| Molecular Weight | 532.17 g/mol |
| LogP | 5.8652 |
| Topological Polar Surface Area | 100.23 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 6 |
| Exact Mass | 532.1747 |
| Heavy Atoms | 40 |
| Complexity | 1901.0795 |
Chemical Identifiers
| CAS Number | 848059-13-2 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)C2C3=C(C=C(C=C3)O)OC4=C2C5=NC(=NN5C=N4)COC6=CC7=CC=CC=C7C=C6)OC |
Product Overview
12-(3,4-dimethoxyphenyl)-2-[(naphthalen-2-yloxy)methyl]-12H-chromeno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-9-ol (CAS 848059-13-2), with molecular formula C31H24N4O5 and molecular weight 532.17 g/mol. IUPAC: 9-(3,4-dimethoxyphenyl)-13-(naphthalen-2-yloxymethyl)-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-(3,4-dimethoxyphenyl)-2-[(naphthalen-2-yloxy)methyl]-12H-chromeno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-9-ol
Property Insights of 12-(3,4-dimethoxyphenyl)-2-[(naphthalen-2-yloxy)methyl]-12H-chromeno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-9-ol
The XLogP value of 5.8652 indicates that 12-(3,4-dimethoxyphenyl)-2-[(naphthalen-2-yloxy)methyl]-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 100.23 Ų falls within the moderate polarity range, balancing permeability and solubility for 12-(3,4-dimethoxyphenyl)-2-[(naphthalen-2-yloxy)methyl]-12H-chromeno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-9-ol. Following Lipinski's Rule of Five, 12-(3,4-dimethoxyphenyl)-2-[(naphthalen-2-yloxy)methyl]-12H-chromeno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-9-ol has 1 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 12-(3,4-dimethoxyphenyl)-2-[(naphthalen-2-yloxy)methyl]-12H-chromeno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-9-ol?
The CAS number of 12-(3,4-dimethoxyphenyl)-2-[(naphthalen-2-yloxy)methyl]-12H-chromeno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-9-ol is 848059-13-2.
What is the molecular formula of 12-(3,4-dimethoxyphenyl)-2-[(naphthalen-2-yloxy)methyl]-12H-chromeno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-9-ol?
The molecular formula of 12-(3,4-dimethoxyphenyl)-2-[(naphthalen-2-yloxy)methyl]-12H-chromeno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-9-ol is C31H24N4O5.
What is the molecular weight of 12-(3,4-dimethoxyphenyl)-2-[(naphthalen-2-yloxy)methyl]-12H-chromeno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-9-ol?
The molecular weight of 12-(3,4-dimethoxyphenyl)-2-[(naphthalen-2-yloxy)methyl]-12H-chromeno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-9-ol is 532.17 g/mol.
Where can I buy 12-(3,4-dimethoxyphenyl)-2-[(naphthalen-2-yloxy)methyl]-12H-chromeno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-9-ol?
You can request a quote for 12-(3,4-dimethoxyphenyl)-2-[(naphthalen-2-yloxy)methyl]-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-(3,4-dimethoxyphenyl)-2-[(naphthalen-2-yloxy)methyl]-12H-chromeno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-9-ol?
Yes, KEHONG BIO provides custom synthesis services for 12-(3,4-dimethoxyphenyl)-2-[(naphthalen-2-yloxy)methyl]-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.