![12-(3,4-dimethoxyphenyl)-10-[3-(1H-imidazol-1-yl)propyl]-10,12-dihydro-11H-benzo[5,6]chromeno[2,3-d]pyrimidin-11-imine structure](/static/products/847/847367-69-5.png)
12-(3,4-dimethoxyphenyl)-10-[3-(1H-imidazol-1-yl)propyl]-10,12-dihydro-11H-benzo[5,6]chromeno[2,3-d]pyrimidin-11-imine
TL;DR: 12-(3,4-dimethoxyphenyl)-10-[3-(1H-imidazol-1-yl)propyl]-10,12-dihydro-11H-benzo[5,6]chromeno[2,3-d]pyrimidin-11-imine (CAS 847367-69-5) is a chemical compound with molecular formula C29H27N5O3 and molecular weight 493.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
18-(3,4-dimethoxyphenyl)-15-(3-imidazol-1-ylpropyl)-11-oxa-13,15-diazatetracyclo[8.8.0.02,7.012,17]octadeca-1(10),2,4,6,8,12(17),13-heptaen-16-imine
Also Known As: 12-(3,4-dimethoxyphenyl)-10-[3-(1H-imidazol-1-yl)propyl]-10,12-dihydro-11H-benzo[5,6]chromeno[2,3-d]pyrimidin-11-imine, 10-(3-(1H-imidazol-1-yl)propyl)-12-(3,4-dimethoxyphenyl)-10H-benzo[5,6]chromeno[2,3-d]pyrimidin-11(12H)-imine
| Molecular Formula | C29H27N5O3 |
|---|---|
| Molecular Weight | 493.21 g/mol |
| LogP | 5.10567 |
| Topological Polar Surface Area | 87.18 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 493.2114 |
| Heavy Atoms | 37 |
| Complexity | 1642.0076 |
Chemical Identifiers
| CAS Number | 847367-69-5 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)C2C3=C(C=CC4=CC=CC=C43)OC5=C2C(=N)N(C=N5)CCCN6C=CN=C6)OC |
Product Overview
12-(3,4-dimethoxyphenyl)-10-[3-(1H-imidazol-1-yl)propyl]-10,12-dihydro-11H-benzo[5,6]chromeno[2,3-d]pyrimidin-11-imine (CAS 847367-69-5), with molecular formula C29H27N5O3 and molecular weight 493.21 g/mol. IUPAC: 18-(3,4-dimethoxyphenyl)-15-(3-imidazol-1-ylpropyl)-11-oxa-13,15-diazatetracyclo[8.8.0.02,7.012,17]octadeca-1(10),2,4,6,8,12(17),13-heptaen-16-imine.
Chemical Property Profile of 12-(3,4-dimethoxyphenyl)-10-[3-(1H-imidazol-1-yl)propyl]-10,12-dihydro-11H-benzo[5,6]chromeno[2,3-d]pyrimidin-11-imine
Property Insights of 12-(3,4-dimethoxyphenyl)-10-[3-(1H-imidazol-1-yl)propyl]-10,12-dihydro-11H-benzo[5,6]chromeno[2,3-d]pyrimidin-11-imine
The XLogP value of 5.10567 indicates that 12-(3,4-dimethoxyphenyl)-10-[3-(1H-imidazol-1-yl)propyl]-10,12-dihydro-11H-benzo[5,6]chromeno[2,3-d]pyrimidin-11-imine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 87.18 Ų falls within the moderate polarity range, balancing permeability and solubility for 12-(3,4-dimethoxyphenyl)-10-[3-(1H-imidazol-1-yl)propyl]-10,12-dihydro-11H-benzo[5,6]chromeno[2,3-d]pyrimidin-11-imine. Following Lipinski's Rule of Five, 12-(3,4-dimethoxyphenyl)-10-[3-(1H-imidazol-1-yl)propyl]-10,12-dihydro-11H-benzo[5,6]chromeno[2,3-d]pyrimidin-11-imine has 1 hydrogen bond donor(s) and 6 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)-10-[3-(1H-imidazol-1-yl)propyl]-10,12-dihydro-11H-benzo[5,6]chromeno[2,3-d]pyrimidin-11-imine?
The CAS number of 12-(3,4-dimethoxyphenyl)-10-[3-(1H-imidazol-1-yl)propyl]-10,12-dihydro-11H-benzo[5,6]chromeno[2,3-d]pyrimidin-11-imine is 847367-69-5.
What is the molecular formula of 12-(3,4-dimethoxyphenyl)-10-[3-(1H-imidazol-1-yl)propyl]-10,12-dihydro-11H-benzo[5,6]chromeno[2,3-d]pyrimidin-11-imine?
The molecular formula of 12-(3,4-dimethoxyphenyl)-10-[3-(1H-imidazol-1-yl)propyl]-10,12-dihydro-11H-benzo[5,6]chromeno[2,3-d]pyrimidin-11-imine is C29H27N5O3.
What is the molecular weight of 12-(3,4-dimethoxyphenyl)-10-[3-(1H-imidazol-1-yl)propyl]-10,12-dihydro-11H-benzo[5,6]chromeno[2,3-d]pyrimidin-11-imine?
The molecular weight of 12-(3,4-dimethoxyphenyl)-10-[3-(1H-imidazol-1-yl)propyl]-10,12-dihydro-11H-benzo[5,6]chromeno[2,3-d]pyrimidin-11-imine is 493.21 g/mol.
Where can I buy 12-(3,4-dimethoxyphenyl)-10-[3-(1H-imidazol-1-yl)propyl]-10,12-dihydro-11H-benzo[5,6]chromeno[2,3-d]pyrimidin-11-imine?
You can request a quote for 12-(3,4-dimethoxyphenyl)-10-[3-(1H-imidazol-1-yl)propyl]-10,12-dihydro-11H-benzo[5,6]chromeno[2,3-d]pyrimidin-11-imine 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)-10-[3-(1H-imidazol-1-yl)propyl]-10,12-dihydro-11H-benzo[5,6]chromeno[2,3-d]pyrimidin-11-imine?
Yes, KEHONG BIO provides custom synthesis services for 12-(3,4-dimethoxyphenyl)-10-[3-(1H-imidazol-1-yl)propyl]-10,12-dihydro-11H-benzo[5,6]chromeno[2,3-d]pyrimidin-11-imine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.