C21H26N6O
TL;DR: C21H26N6O (CAS 904509-38-2) is a chemical compound with molecular formula C21H26N6O and molecular weight 378.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[4-(4-methoxyphenyl)-11,12-dimethyl-3,5,6,8,10-pentazatricyclo[7.3.0.02,6]dodeca-1(9),2,4,7,11-pentaen-10-yl]-N,N-dimethylpropan-1-amine
Also Known As: 3-(2-(4-methoxyphenyl)-8,9-dimethyl-7H-pyrrolo[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-7-yl)-N,N-dimethylpropan-1-amine, 3-[2-(4-methoxyphenyl)-8,9-dimethyl-7H-pyrrolo[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-7-yl]-N,N-dimethylpropan-1-amine
| Molecular Formula | C21H26N6O |
|---|---|
| Molecular Weight | 378.22 g/mol |
| LogP | 3.32314 |
| Topological Polar Surface Area | 60.48 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 378.2168 |
| Heavy Atoms | 28 |
| Complexity | 1123.669 |
Chemical Identifiers
| CAS Number | 904509-38-2 |
|---|---|
| SMILES | CC1=C(N(C2=C1C3=NC(=NN3C=N2)C4=CC=C(C=C4)OC)CCCN(C)C)C |
Product Overview
C21H26N6O (CAS 904509-38-2), with molecular formula C21H26N6O and molecular weight 378.22 g/mol. IUPAC: 3-[4-(4-methoxyphenyl)-11,12-dimethyl-3,5,6,8,10-pentazatricyclo[7.3.0.02,6]dodeca-1(9),2,4,7,11-pentaen-10-yl]-N,N-dimethylpropan-1-amine.
Chemical Property Profile of C21H26N6O
Property Insights of C21H26N6O
The XLogP value of 3.32314 indicates that C21H26N6O is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 60.48 Ų falls within the moderate polarity range, balancing permeability and solubility for C21H26N6O. Following Lipinski's Rule of Five, C21H26N6O has 0 hydrogen bond donor(s) and 5 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 C21H26N6O?
The CAS number of C21H26N6O is 904509-38-2.
What is the molecular formula of C21H26N6O?
The molecular formula of C21H26N6O is C21H26N6O.
What is the molecular weight of C21H26N6O?
The molecular weight of C21H26N6O is 378.22 g/mol.
Where can I buy C21H26N6O?
You can request a quote for C21H26N6O directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for C21H26N6O?
Yes, KEHONG BIO provides custom synthesis services for C21H26N6O and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.