![2,6-Diethyl-5-[(3-nitrophenyl)methylsulfanyl]pyrazolo[4,3-d]pyrimidin-7-one structure](/static/products/832/832115-40-9.png)
2,6-Diethyl-5-[(3-nitrophenyl)methylsulfanyl]pyrazolo[4,3-d]pyrimidin-7-one
TL;DR: 2,6-Diethyl-5-[(3-nitrophenyl)methylsulfanyl]pyrazolo[4,3-d]pyrimidin-7-one (CAS 832115-40-9) is a chemical compound with molecular formula C16H17N5O3S and molecular weight 359.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,6-diethyl-5-[(3-nitrophenyl)methylsulfanyl]pyrazolo[4,3-d]pyrimidin-7-one
Also Known As: 2,6-diethyl-5-[(3-nitrophenyl)methylsulfanyl]pyrazolo[4,3-d]pyrimidin-7-one, 2,6-diethyl-5-[(3-nitrobenzyl)sulfanyl]-2,6-dihydro-7H-pyrazolo[4,3-d]pyrimidin-7-one, 3,8-diethyl-4-[(3-nitrophenyl)methylsulfanyl]-3,5,8,9-tetrazabicyclo[4.3.0]nona-4,6,9-trien-2-one
| Molecular Formula | C16H17N5O3S |
|---|---|
| Molecular Weight | 359.11 g/mol |
| LogP | 2.8333 |
| Topological Polar Surface Area | 95.85 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 359.10522 |
| Heavy Atoms | 25 |
| Complexity | 995.0891 |
Chemical Identifiers
| CAS Number | 832115-40-9 |
|---|---|
| SMILES | CCN1C=C2C(=N1)C(=O)N(C(=N2)SCC3=CC(=CC=C3)[N+](=O)[O-])CC |
Product Overview
2,6-Diethyl-5-[(3-nitrophenyl)methylsulfanyl]pyrazolo[4,3-d]pyrimidin-7-one (CAS 832115-40-9), with molecular formula C16H17N5O3S and molecular weight 359.11 g/mol. IUPAC: 2,6-diethyl-5-[(3-nitrophenyl)methylsulfanyl]pyrazolo[4,3-d]pyrimidin-7-one.
Chemical Property Profile of 2,6-Diethyl-5-[(3-nitrophenyl)methylsulfanyl]pyrazolo[4,3-d]pyrimidin-7-one
Property Insights of 2,6-Diethyl-5-[(3-nitrophenyl)methylsulfanyl]pyrazolo[4,3-d]pyrimidin-7-one
The XLogP value of 2.8333 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,6-Diethyl-5-[(3-nitrophenyl)methylsulfanyl]pyrazolo[4,3-d]pyrimidin-7-one. The TPSA of 95.85 Ų falls within the moderate polarity range, balancing permeability and solubility for 2,6-Diethyl-5-[(3-nitrophenyl)methylsulfanyl]pyrazolo[4,3-d]pyrimidin-7-one. Following Lipinski's Rule of Five, 2,6-Diethyl-5-[(3-nitrophenyl)methylsulfanyl]pyrazolo[4,3-d]pyrimidin-7-one has 0 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 2,6-Diethyl-5-[(3-nitrophenyl)methylsulfanyl]pyrazolo[4,3-d]pyrimidin-7-one?
The CAS number of 2,6-Diethyl-5-[(3-nitrophenyl)methylsulfanyl]pyrazolo[4,3-d]pyrimidin-7-one is 832115-40-9.
What is the molecular formula of 2,6-Diethyl-5-[(3-nitrophenyl)methylsulfanyl]pyrazolo[4,3-d]pyrimidin-7-one?
The molecular formula of 2,6-Diethyl-5-[(3-nitrophenyl)methylsulfanyl]pyrazolo[4,3-d]pyrimidin-7-one is C16H17N5O3S.
What is the molecular weight of 2,6-Diethyl-5-[(3-nitrophenyl)methylsulfanyl]pyrazolo[4,3-d]pyrimidin-7-one?
The molecular weight of 2,6-Diethyl-5-[(3-nitrophenyl)methylsulfanyl]pyrazolo[4,3-d]pyrimidin-7-one is 359.11 g/mol.
Where can I buy 2,6-Diethyl-5-[(3-nitrophenyl)methylsulfanyl]pyrazolo[4,3-d]pyrimidin-7-one?
You can request a quote for 2,6-Diethyl-5-[(3-nitrophenyl)methylsulfanyl]pyrazolo[4,3-d]pyrimidin-7-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,6-Diethyl-5-[(3-nitrophenyl)methylsulfanyl]pyrazolo[4,3-d]pyrimidin-7-one?
Yes, KEHONG BIO provides custom synthesis services for 2,6-Diethyl-5-[(3-nitrophenyl)methylsulfanyl]pyrazolo[4,3-d]pyrimidin-7-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.