![9-butyl-7-(4-methoxyphenyl)-7H-benzo[7,8]chromeno[2,3-d]pyrimidin-8(9H)-imine structure](/static/products/845/845991-23-3.png)
9-butyl-7-(4-methoxyphenyl)-7H-benzo[7,8]chromeno[2,3-d]pyrimidin-8(9H)-imine
TL;DR: 9-butyl-7-(4-methoxyphenyl)-7H-benzo[7,8]chromeno[2,3-d]pyrimidin-8(9H)-imine (CAS 845991-23-3) is a chemical compound with molecular formula C26H25N3O2 and molecular weight 411.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
14-butyl-11-(4-methoxyphenyl)-18-oxa-14,16-diazatetracyclo[8.8.0.02,7.012,17]octadeca-1(10),2,4,6,8,12(17),15-heptaen-13-imine
Also Known As: 9-butyl-7-(4-methoxyphenyl)-7,9-dihydro-8H-benzo[7,8]chromeno[2,3-d]pyrimidin-8-imine, 9-butyl-7-(4-methoxyphenyl)-7H-benzo[7,8]chromeno[2,3-d]pyrimidin-8(9H)-imine
| Molecular Formula | C26H25N3O2 |
|---|---|
| Molecular Weight | 411.19 g/mol |
| LogP | 5.61037 |
| Topological Polar Surface Area | 60.13 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 411.19467 |
| Heavy Atoms | 31 |
| Complexity | 1308.7855 |
Chemical Identifiers
| CAS Number | 845991-23-3 |
|---|---|
| SMILES | CCCCN1C=NC2=C(C1=N)C(C3=C(O2)C4=CC=CC=C4C=C3)C5=CC=C(C=C5)OC |
Product Overview
9-butyl-7-(4-methoxyphenyl)-7H-benzo[7,8]chromeno[2,3-d]pyrimidin-8(9H)-imine (CAS 845991-23-3), with molecular formula C26H25N3O2 and molecular weight 411.19 g/mol. IUPAC: 14-butyl-11-(4-methoxyphenyl)-18-oxa-14,16-diazatetracyclo[8.8.0.02,7.012,17]octadeca-1(10),2,4,6,8,12(17),15-heptaen-13-imine.
Chemical Property Profile of 9-butyl-7-(4-methoxyphenyl)-7H-benzo[7,8]chromeno[2,3-d]pyrimidin-8(9H)-imine
Property Insights of 9-butyl-7-(4-methoxyphenyl)-7H-benzo[7,8]chromeno[2,3-d]pyrimidin-8(9H)-imine
The XLogP value of 5.61037 indicates that 9-butyl-7-(4-methoxyphenyl)-7H-benzo[7,8]chromeno[2,3-d]pyrimidin-8(9H)-imine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 60.13 Ų falls within the moderate polarity range, balancing permeability and solubility for 9-butyl-7-(4-methoxyphenyl)-7H-benzo[7,8]chromeno[2,3-d]pyrimidin-8(9H)-imine. Following Lipinski's Rule of Five, 9-butyl-7-(4-methoxyphenyl)-7H-benzo[7,8]chromeno[2,3-d]pyrimidin-8(9H)-imine has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 9-butyl-7-(4-methoxyphenyl)-7H-benzo[7,8]chromeno[2,3-d]pyrimidin-8(9H)-imine?
The CAS number of 9-butyl-7-(4-methoxyphenyl)-7H-benzo[7,8]chromeno[2,3-d]pyrimidin-8(9H)-imine is 845991-23-3.
What is the molecular formula of 9-butyl-7-(4-methoxyphenyl)-7H-benzo[7,8]chromeno[2,3-d]pyrimidin-8(9H)-imine?
The molecular formula of 9-butyl-7-(4-methoxyphenyl)-7H-benzo[7,8]chromeno[2,3-d]pyrimidin-8(9H)-imine is C26H25N3O2.
What is the molecular weight of 9-butyl-7-(4-methoxyphenyl)-7H-benzo[7,8]chromeno[2,3-d]pyrimidin-8(9H)-imine?
The molecular weight of 9-butyl-7-(4-methoxyphenyl)-7H-benzo[7,8]chromeno[2,3-d]pyrimidin-8(9H)-imine is 411.19 g/mol.
Where can I buy 9-butyl-7-(4-methoxyphenyl)-7H-benzo[7,8]chromeno[2,3-d]pyrimidin-8(9H)-imine?
You can request a quote for 9-butyl-7-(4-methoxyphenyl)-7H-benzo[7,8]chromeno[2,3-d]pyrimidin-8(9H)-imine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 9-butyl-7-(4-methoxyphenyl)-7H-benzo[7,8]chromeno[2,3-d]pyrimidin-8(9H)-imine?
Yes, KEHONG BIO provides custom synthesis services for 9-butyl-7-(4-methoxyphenyl)-7H-benzo[7,8]chromeno[2,3-d]pyrimidin-8(9H)-imine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.