![(4aR)-3-(4-dimethylaminophenyl)-4a-(1H-indol-3-yl)-6,8-dimethyl-2H-pyrimido[5,4-e][1,2,4]triazine-5,7-dione structure](/static/products/308/308366-11-2.png)
(4aR)-3-(4-dimethylaminophenyl)-4a-(1H-indol-3-yl)-6,8-dimethyl-2H-pyrimido[5,4-e][1,2,4]triazine-5,7-dione
TL;DR: (4aR)-3-(4-dimethylaminophenyl)-4a-(1H-indol-3-yl)-6,8-dimethyl-2H-pyrimido[5,4-e][1,2,4]triazine-5,7-dione (CAS 308366-11-2) is a chemical compound with molecular formula C23H23N7O2 and molecular weight 429.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4aR)-3-[4-(dimethylamino)phenyl]-4a-(1H-indol-3-yl)-6,8-dimethyl-2H-pyrimido[5,4-e][1,2,4]triazine-5,7-dione
Also Known As: (4aR)-3-(4-dimethylaminophenyl)-4a-(1H-indol-3-yl)-6,8-dimethyl-2H-pyrimido[5,4-e][1,2,4]triazine-5,7-dione, (R)-3-(4-(dimethylamino)phenyl)-4a-(1H-indol-3-yl)-6,8-dimethyl-6,8-dihydropyrimido[5,4-e][1,2,4]triazine-5,7(2H,4aH)-dione
| Molecular Formula | C23H23N7O2 |
|---|---|
| Molecular Weight | 429.19 g/mol |
| LogP | 2.3165 |
| Topological Polar Surface Area | 96.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 429.1913 |
| Heavy Atoms | 32 |
| Complexity | 1305.386 |
Chemical Identifiers
| CAS Number | 308366-11-2 |
|---|---|
| SMILES | CN1C2=NNC(=N[C@]2(C(=O)N(C1=O)C)C3=CNC4=CC=CC=C43)C5=CC=C(C=C5)N(C)C |
Product Overview
(4aR)-3-(4-dimethylaminophenyl)-4a-(1H-indol-3-yl)-6,8-dimethyl-2H-pyrimido[5,4-e][1,2,4]triazine-5,7-dione (CAS 308366-11-2), with molecular formula C23H23N7O2 and molecular weight 429.19 g/mol. IUPAC: (4aR)-3-[4-(dimethylamino)phenyl]-4a-(1H-indol-3-yl)-6,8-dimethyl-2H-pyrimido[5,4-e][1,2,4]triazine-5,7-dione.
Chemical Property Profile of (4aR)-3-(4-dimethylaminophenyl)-4a-(1H-indol-3-yl)-6,8-dimethyl-2H-pyrimido[5,4-e][1,2,4]triazine-5,7-dione
Property Insights of (4aR)-3-(4-dimethylaminophenyl)-4a-(1H-indol-3-yl)-6,8-dimethyl-2H-pyrimido[5,4-e][1,2,4]triazine-5,7-dione
The XLogP value of 2.3165 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (4aR)-3-(4-dimethylaminophenyl)-4a-(1H-indol-3-yl)-6,8-dimethyl-2H-pyrimido[5,4-e][1,2,4]triazine-5,7-dione. The TPSA of 96.4 Ų falls within the moderate polarity range, balancing permeability and solubility for (4aR)-3-(4-dimethylaminophenyl)-4a-(1H-indol-3-yl)-6,8-dimethyl-2H-pyrimido[5,4-e][1,2,4]triazine-5,7-dione. Following Lipinski's Rule of Five, (4aR)-3-(4-dimethylaminophenyl)-4a-(1H-indol-3-yl)-6,8-dimethyl-2H-pyrimido[5,4-e][1,2,4]triazine-5,7-dione has 2 hydrogen bond donor(s) and 6 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 (4aR)-3-(4-dimethylaminophenyl)-4a-(1H-indol-3-yl)-6,8-dimethyl-2H-pyrimido[5,4-e][1,2,4]triazine-5,7-dione?
The CAS number of (4aR)-3-(4-dimethylaminophenyl)-4a-(1H-indol-3-yl)-6,8-dimethyl-2H-pyrimido[5,4-e][1,2,4]triazine-5,7-dione is 308366-11-2.
What is the molecular formula of (4aR)-3-(4-dimethylaminophenyl)-4a-(1H-indol-3-yl)-6,8-dimethyl-2H-pyrimido[5,4-e][1,2,4]triazine-5,7-dione?
The molecular formula of (4aR)-3-(4-dimethylaminophenyl)-4a-(1H-indol-3-yl)-6,8-dimethyl-2H-pyrimido[5,4-e][1,2,4]triazine-5,7-dione is C23H23N7O2.
What is the molecular weight of (4aR)-3-(4-dimethylaminophenyl)-4a-(1H-indol-3-yl)-6,8-dimethyl-2H-pyrimido[5,4-e][1,2,4]triazine-5,7-dione?
The molecular weight of (4aR)-3-(4-dimethylaminophenyl)-4a-(1H-indol-3-yl)-6,8-dimethyl-2H-pyrimido[5,4-e][1,2,4]triazine-5,7-dione is 429.19 g/mol.
Where can I buy (4aR)-3-(4-dimethylaminophenyl)-4a-(1H-indol-3-yl)-6,8-dimethyl-2H-pyrimido[5,4-e][1,2,4]triazine-5,7-dione?
You can request a quote for (4aR)-3-(4-dimethylaminophenyl)-4a-(1H-indol-3-yl)-6,8-dimethyl-2H-pyrimido[5,4-e][1,2,4]triazine-5,7-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (4aR)-3-(4-dimethylaminophenyl)-4a-(1H-indol-3-yl)-6,8-dimethyl-2H-pyrimido[5,4-e][1,2,4]triazine-5,7-dione?
Yes, KEHONG BIO provides custom synthesis services for (4aR)-3-(4-dimethylaminophenyl)-4a-(1H-indol-3-yl)-6,8-dimethyl-2H-pyrimido[5,4-e][1,2,4]triazine-5,7-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.