![6-butyl-5-(4-tert-butylphenyl)-1,3-dimethylpyrrolo[3,4-d]pyrimidine-2,4-dione structure](/static/products/845/845650-48-8.png)
6-butyl-5-(4-tert-butylphenyl)-1,3-dimethylpyrrolo[3,4-d]pyrimidine-2,4-dione
TL;DR: 6-butyl-5-(4-tert-butylphenyl)-1,3-dimethylpyrrolo[3,4-d]pyrimidine-2,4-dione (CAS 845650-48-8) is a chemical compound with molecular formula C22H29N3O2 and molecular weight 367.23 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-butyl-5-(4-tert-butylphenyl)-1,3-dimethylpyrrolo[3,4-d]pyrimidine-2,4-dione
Also Known As: 6-butyl-5-(4-tert-butylphenyl)-1,3-dimethylpyrrolo[3,4-d]pyrimidine-2,4-dione, 6-butyl-5-(4-(tert-butyl)phenyl)-1,3-dimethyl-1H-pyrrolo[3,4-d]pyrimidine-2,4(3H,6H)-dione, 6-butyl-5-(4-tert-butylphenyl)-1,3-dimethyl-1H-pyrrolo[3,4-d]pyrimidine-2,4(3H,6H)-dione
| Molecular Formula | C22H29N3O2 |
|---|---|
| Molecular Weight | 367.23 g/mol |
| LogP | 3.8033 |
| Topological Polar Surface Area | 48.93 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 367.22598 |
| Heavy Atoms | 27 |
| Complexity | 1090.2542 |
Chemical Identifiers
| CAS Number | 845650-48-8 |
|---|---|
| SMILES | CCCCN1C=C2C(=C1C3=CC=C(C=C3)C(C)(C)C)C(=O)N(C(=O)N2C)C |
Product Overview
6-butyl-5-(4-tert-butylphenyl)-1,3-dimethylpyrrolo[3,4-d]pyrimidine-2,4-dione (CAS 845650-48-8), with molecular formula C22H29N3O2 and molecular weight 367.23 g/mol. IUPAC: 6-butyl-5-(4-tert-butylphenyl)-1,3-dimethylpyrrolo[3,4-d]pyrimidine-2,4-dione.
Chemical Property Profile of 6-butyl-5-(4-tert-butylphenyl)-1,3-dimethylpyrrolo[3,4-d]pyrimidine-2,4-dione
Property Insights of 6-butyl-5-(4-tert-butylphenyl)-1,3-dimethylpyrrolo[3,4-d]pyrimidine-2,4-dione
The XLogP value of 3.8033 indicates that 6-butyl-5-(4-tert-butylphenyl)-1,3-dimethylpyrrolo[3,4-d]pyrimidine-2,4-dione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 48.93 Ų, 6-butyl-5-(4-tert-butylphenyl)-1,3-dimethylpyrrolo[3,4-d]pyrimidine-2,4-dione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6-butyl-5-(4-tert-butylphenyl)-1,3-dimethylpyrrolo[3,4-d]pyrimidine-2,4-dione has 0 hydrogen bond donor(s) and 2 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 6-butyl-5-(4-tert-butylphenyl)-1,3-dimethylpyrrolo[3,4-d]pyrimidine-2,4-dione?
The CAS number of 6-butyl-5-(4-tert-butylphenyl)-1,3-dimethylpyrrolo[3,4-d]pyrimidine-2,4-dione is 845650-48-8.
What is the molecular formula of 6-butyl-5-(4-tert-butylphenyl)-1,3-dimethylpyrrolo[3,4-d]pyrimidine-2,4-dione?
The molecular formula of 6-butyl-5-(4-tert-butylphenyl)-1,3-dimethylpyrrolo[3,4-d]pyrimidine-2,4-dione is C22H29N3O2.
What is the molecular weight of 6-butyl-5-(4-tert-butylphenyl)-1,3-dimethylpyrrolo[3,4-d]pyrimidine-2,4-dione?
The molecular weight of 6-butyl-5-(4-tert-butylphenyl)-1,3-dimethylpyrrolo[3,4-d]pyrimidine-2,4-dione is 367.23 g/mol.
Where can I buy 6-butyl-5-(4-tert-butylphenyl)-1,3-dimethylpyrrolo[3,4-d]pyrimidine-2,4-dione?
You can request a quote for 6-butyl-5-(4-tert-butylphenyl)-1,3-dimethylpyrrolo[3,4-d]pyrimidine-2,4-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-butyl-5-(4-tert-butylphenyl)-1,3-dimethylpyrrolo[3,4-d]pyrimidine-2,4-dione?
Yes, KEHONG BIO provides custom synthesis services for 6-butyl-5-(4-tert-butylphenyl)-1,3-dimethylpyrrolo[3,4-d]pyrimidine-2,4-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.