![5-(2,4-dichlorophenyl)-6-(3-(diethylamino)propyl)-1,3-dimethyl-1H-pyrrolo[3,4-d]pyrimidine-2,4(3H,6H)-dione structure](/static/products/904/904512-39-6.png)
5-(2,4-dichlorophenyl)-6-(3-(diethylamino)propyl)-1,3-dimethyl-1H-pyrrolo[3,4-d]pyrimidine-2,4(3H,6H)-dione
TL;DR: 5-(2,4-dichlorophenyl)-6-(3-(diethylamino)propyl)-1,3-dimethyl-1H-pyrrolo[3,4-d]pyrimidine-2,4(3H,6H)-dione (CAS 904512-39-6) is a chemical compound with molecular formula C21H26Cl2N4O2 and molecular weight 436.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-(2,4-dichlorophenyl)-6-[3-(diethylamino)propyl]-1,3-dimethylpyrrolo[3,4-d]pyrimidine-2,4-dione
Also Known As: 5-(2,4-dichlorophenyl)-6-(3-(diethylamino)propyl)-1,3-dimethyl-1H-pyrrolo[3,4-d]pyrimidine-2,4(3H,6H)-dione, 5-(2,4-dichlorophenyl)-6-[3-(diethylamino)propyl]-1,3-dimethyl-1H-pyrrolo[3,4-d]pyrimidine-2,4(3H,6H)-dione, 5-(2,4-dichlorophenyl)-6-[3-(diethylamino)propyl]-1,3-dimethylpyrrolo[3,4-d]pyrimidine-2,4-dione
| Molecular Formula | C21H26Cl2N4O2 |
|---|---|
| Molecular Weight | 436.14 g/mol |
| LogP | 3.7444 |
| Topological Polar Surface Area | 52.17 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 7 |
| Exact Mass | 436.14328 |
| Heavy Atoms | 29 |
| Complexity | 1156.1682 |
Chemical Identifiers
| CAS Number | 904512-39-6 |
|---|---|
| SMILES | CCN(CC)CCCN1C=C2C(=C1C3=C(C=C(C=C3)Cl)Cl)C(=O)N(C(=O)N2C)C |
Product Overview
5-(2,4-dichlorophenyl)-6-(3-(diethylamino)propyl)-1,3-dimethyl-1H-pyrrolo[3,4-d]pyrimidine-2,4(3H,6H)-dione (CAS 904512-39-6), with molecular formula C21H26Cl2N4O2 and molecular weight 436.14 g/mol. IUPAC: 5-(2,4-dichlorophenyl)-6-[3-(diethylamino)propyl]-1,3-dimethylpyrrolo[3,4-d]pyrimidine-2,4-dione.
Chemical Property Profile of 5-(2,4-dichlorophenyl)-6-(3-(diethylamino)propyl)-1,3-dimethyl-1H-pyrrolo[3,4-d]pyrimidine-2,4(3H,6H)-dione
Property Insights of 5-(2,4-dichlorophenyl)-6-(3-(diethylamino)propyl)-1,3-dimethyl-1H-pyrrolo[3,4-d]pyrimidine-2,4(3H,6H)-dione
The XLogP value of 3.7444 indicates that 5-(2,4-dichlorophenyl)-6-(3-(diethylamino)propyl)-1,3-dimethyl-1H-pyrrolo[3,4-d]pyrimidine-2,4(3H,6H)-dione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.17 Ų, 5-(2,4-dichlorophenyl)-6-(3-(diethylamino)propyl)-1,3-dimethyl-1H-pyrrolo[3,4-d]pyrimidine-2,4(3H,6H)-dione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-(2,4-dichlorophenyl)-6-(3-(diethylamino)propyl)-1,3-dimethyl-1H-pyrrolo[3,4-d]pyrimidine-2,4(3H,6H)-dione has 0 hydrogen bond donor(s) and 3 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 5-(2,4-dichlorophenyl)-6-(3-(diethylamino)propyl)-1,3-dimethyl-1H-pyrrolo[3,4-d]pyrimidine-2,4(3H,6H)-dione?
The CAS number of 5-(2,4-dichlorophenyl)-6-(3-(diethylamino)propyl)-1,3-dimethyl-1H-pyrrolo[3,4-d]pyrimidine-2,4(3H,6H)-dione is 904512-39-6.
What is the molecular formula of 5-(2,4-dichlorophenyl)-6-(3-(diethylamino)propyl)-1,3-dimethyl-1H-pyrrolo[3,4-d]pyrimidine-2,4(3H,6H)-dione?
The molecular formula of 5-(2,4-dichlorophenyl)-6-(3-(diethylamino)propyl)-1,3-dimethyl-1H-pyrrolo[3,4-d]pyrimidine-2,4(3H,6H)-dione is C21H26Cl2N4O2.
What is the molecular weight of 5-(2,4-dichlorophenyl)-6-(3-(diethylamino)propyl)-1,3-dimethyl-1H-pyrrolo[3,4-d]pyrimidine-2,4(3H,6H)-dione?
The molecular weight of 5-(2,4-dichlorophenyl)-6-(3-(diethylamino)propyl)-1,3-dimethyl-1H-pyrrolo[3,4-d]pyrimidine-2,4(3H,6H)-dione is 436.14 g/mol.
Where can I buy 5-(2,4-dichlorophenyl)-6-(3-(diethylamino)propyl)-1,3-dimethyl-1H-pyrrolo[3,4-d]pyrimidine-2,4(3H,6H)-dione?
You can request a quote for 5-(2,4-dichlorophenyl)-6-(3-(diethylamino)propyl)-1,3-dimethyl-1H-pyrrolo[3,4-d]pyrimidine-2,4(3H,6H)-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-(2,4-dichlorophenyl)-6-(3-(diethylamino)propyl)-1,3-dimethyl-1H-pyrrolo[3,4-d]pyrimidine-2,4(3H,6H)-dione?
Yes, KEHONG BIO provides custom synthesis services for 5-(2,4-dichlorophenyl)-6-(3-(diethylamino)propyl)-1,3-dimethyl-1H-pyrrolo[3,4-d]pyrimidine-2,4(3H,6H)-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.