![N-(4-(1,3-dimethyl-2,4-dioxo-5-(m-tolyl)-3,4-dihydro-1H-pyrrolo[3,4-d]pyrimidin-6(2H)-yl)phenyl)acetamide structure](/static/products/847/847378-56-7.png)
N-(4-(1,3-dimethyl-2,4-dioxo-5-(m-tolyl)-3,4-dihydro-1H-pyrrolo[3,4-d]pyrimidin-6(2H)-yl)phenyl)acetamide
TL;DR: N-(4-(1,3-dimethyl-2,4-dioxo-5-(m-tolyl)-3,4-dihydro-1H-pyrrolo[3,4-d]pyrimidin-6(2H)-yl)phenyl)acetamide (CAS 847378-56-7) is a chemical compound with molecular formula C23H22N4O3 and molecular weight 402.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[4-[1,3-dimethyl-5-(3-methylphenyl)-2,4-dioxopyrrolo[3,4-d]pyrimidin-6-yl]phenyl]acetamide
Also Known As: N-(4-(1,3-dimethyl-2,4-dioxo-5-(m-tolyl)-3,4-dihydro-1H-pyrrolo[3,4-d]pyrimidin-6(2H)-yl)phenyl)acetamide, N-[4-[1,3-dimethyl-5-(3-methylphenyl)-2,4-dioxopyrrolo[3,4-d]pyrimidin-6-yl]phenyl]acetamide, N-{4-[1,3-dimethyl-5-(3-methylphenyl)-2,4-dioxo-1,2,3,4-tetrahydro-6H-pyrrolo[3,4-d]pyrimidin-6-yl]phenyl}acetamide
| Molecular Formula | C23H22N4O3 |
|---|---|
| Molecular Weight | 402.17 g/mol |
| LogP | 2.96172 |
| Topological Polar Surface Area | 78.03 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 402.1692 |
| Heavy Atoms | 30 |
| Complexity | 1405.6454 |
Chemical Identifiers
| CAS Number | 847378-56-7 |
|---|---|
| SMILES | CC1=CC(=CC=C1)C2=C3C(=CN2C4=CC=C(C=C4)NC(=O)C)N(C(=O)N(C3=O)C)C |
Product Overview
N-(4-(1,3-dimethyl-2,4-dioxo-5-(m-tolyl)-3,4-dihydro-1H-pyrrolo[3,4-d]pyrimidin-6(2H)-yl)phenyl)acetamide (CAS 847378-56-7), with molecular formula C23H22N4O3 and molecular weight 402.17 g/mol. IUPAC: N-[4-[1,3-dimethyl-5-(3-methylphenyl)-2,4-dioxopyrrolo[3,4-d]pyrimidin-6-yl]phenyl]acetamide.
Chemical Property Profile of N-(4-(1,3-dimethyl-2,4-dioxo-5-(m-tolyl)-3,4-dihydro-1H-pyrrolo[3,4-d]pyrimidin-6(2H)-yl)phenyl)acetamide
Property Insights of N-(4-(1,3-dimethyl-2,4-dioxo-5-(m-tolyl)-3,4-dihydro-1H-pyrrolo[3,4-d]pyrimidin-6(2H)-yl)phenyl)acetamide
The XLogP value of 2.96172 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(4-(1,3-dimethyl-2,4-dioxo-5-(m-tolyl)-3,4-dihydro-1H-pyrrolo[3,4-d]pyrimidin-6(2H)-yl)phenyl)acetamide. The TPSA of 78.03 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(4-(1,3-dimethyl-2,4-dioxo-5-(m-tolyl)-3,4-dihydro-1H-pyrrolo[3,4-d]pyrimidin-6(2H)-yl)phenyl)acetamide. Following Lipinski's Rule of Five, N-(4-(1,3-dimethyl-2,4-dioxo-5-(m-tolyl)-3,4-dihydro-1H-pyrrolo[3,4-d]pyrimidin-6(2H)-yl)phenyl)acetamide has 1 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 N-(4-(1,3-dimethyl-2,4-dioxo-5-(m-tolyl)-3,4-dihydro-1H-pyrrolo[3,4-d]pyrimidin-6(2H)-yl)phenyl)acetamide?
The CAS number of N-(4-(1,3-dimethyl-2,4-dioxo-5-(m-tolyl)-3,4-dihydro-1H-pyrrolo[3,4-d]pyrimidin-6(2H)-yl)phenyl)acetamide is 847378-56-7.
What is the molecular formula of N-(4-(1,3-dimethyl-2,4-dioxo-5-(m-tolyl)-3,4-dihydro-1H-pyrrolo[3,4-d]pyrimidin-6(2H)-yl)phenyl)acetamide?
The molecular formula of N-(4-(1,3-dimethyl-2,4-dioxo-5-(m-tolyl)-3,4-dihydro-1H-pyrrolo[3,4-d]pyrimidin-6(2H)-yl)phenyl)acetamide is C23H22N4O3.
What is the molecular weight of N-(4-(1,3-dimethyl-2,4-dioxo-5-(m-tolyl)-3,4-dihydro-1H-pyrrolo[3,4-d]pyrimidin-6(2H)-yl)phenyl)acetamide?
The molecular weight of N-(4-(1,3-dimethyl-2,4-dioxo-5-(m-tolyl)-3,4-dihydro-1H-pyrrolo[3,4-d]pyrimidin-6(2H)-yl)phenyl)acetamide is 402.17 g/mol.
Where can I buy N-(4-(1,3-dimethyl-2,4-dioxo-5-(m-tolyl)-3,4-dihydro-1H-pyrrolo[3,4-d]pyrimidin-6(2H)-yl)phenyl)acetamide?
You can request a quote for N-(4-(1,3-dimethyl-2,4-dioxo-5-(m-tolyl)-3,4-dihydro-1H-pyrrolo[3,4-d]pyrimidin-6(2H)-yl)phenyl)acetamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(4-(1,3-dimethyl-2,4-dioxo-5-(m-tolyl)-3,4-dihydro-1H-pyrrolo[3,4-d]pyrimidin-6(2H)-yl)phenyl)acetamide?
Yes, KEHONG BIO provides custom synthesis services for N-(4-(1,3-dimethyl-2,4-dioxo-5-(m-tolyl)-3,4-dihydro-1H-pyrrolo[3,4-d]pyrimidin-6(2H)-yl)phenyl)acetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.