RefChem:285855
TL;DR: RefChem:285855 (CAS 889952-09-4) is a chemical compound with molecular formula C21H18N4O3 and molecular weight 374.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-(4-methoxyphenyl)-9-methyl-1,3,9,11-tetrazatetracyclo[8.7.0.02,7.012,17]heptadeca-2(7),10,12,14,16-pentaene-4,8-dione
Also Known As: A3922/0166881, 4,6-Dihydro-4-(4-methoxyphenyl)-6-methylpyrido[3',2':5,6]pyrimido[1,2-a]benzimidazole-2,5(1H,3H)-dione, 4-(4-methoxyphenyl)-6-methyl-3,4-dihydropyrido[3',2':5,6]pyrimido[1,2-a]benzimidazole-2,5(1H,6H)-dione, 4,6-Dihydro-4-(4-methoxyphenyl)-6-methylpyrido(3',2':5,6)pyrimido(1,2-a)benzimidazole-2,5(1H,3H)-dione, 4,6-Dihydro-4-(4-methoxyphenyl)-6-methylpyrido[3a(2),2a(2):5,6]pyrimido[1,2-a]benzimidazole-2,5(1H,3H)-dione
| Molecular Formula | C21H18N4O3 |
|---|---|
| Molecular Weight | 374.14 g/mol |
| LogP | 2.6689 |
| Topological Polar Surface Area | 77.63 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 374.13788 |
| Heavy Atoms | 28 |
| Complexity | 1301.4728 |
Chemical Identifiers
| CAS Number | 889952-09-4 |
|---|---|
| SMILES | CN1C(=O)C2=C(NC(=O)CC2C3=CC=C(C=C3)OC)N4C1=NC5=CC=CC=C54 |
Product Overview
RefChem:285855 (CAS 889952-09-4), with molecular formula C21H18N4O3 and molecular weight 374.14 g/mol. IUPAC: 6-(4-methoxyphenyl)-9-methyl-1,3,9,11-tetrazatetracyclo[8.7.0.02,7.012,17]heptadeca-2(7),10,12,14,16-pentaene-4,8-dione.
Chemical Property Profile of RefChem:285855
Property Insights of RefChem:285855
The XLogP value of 2.6689 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:285855. The TPSA of 77.63 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:285855. Following Lipinski's Rule of Five, RefChem:285855 has 1 hydrogen bond donor(s) and 4 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 RefChem:285855?
The CAS number of RefChem:285855 is 889952-09-4.
What is the molecular formula of RefChem:285855?
The molecular formula of RefChem:285855 is C21H18N4O3.
What is the molecular weight of RefChem:285855?
The molecular weight of RefChem:285855 is 374.14 g/mol.
Where can I buy RefChem:285855?
You can request a quote for RefChem:285855 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:285855?
Yes, KEHONG BIO provides custom synthesis services for RefChem:285855 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.