N(1)-Cyclopentyl-5-nitropyrimidine-2,4-dione
TL;DR: N(1)-Cyclopentyl-5-nitropyrimidine-2,4-dione (CAS 1595-18-2) is a chemical compound with molecular formula C9H11N3O4 and molecular weight 225.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-cyclopentyl-5-nitropyrimidine-2,4-dione
Also Known As: C-NO2dUrd, 1-cyclopentyl-5-nitropyrimidine-2,4-dione, N(1)-Cyclopentyl-5-nitropyrimidine-2,4-dione, N-1-Cyclopentyl-5-nitro-2,4-pyrimidinedione, 2,4(1H,3H)-Pyrimidinedione, 1-cyclopentyl-5-nitro-
| Molecular Formula | C9H11N3O4 |
|---|---|
| Molecular Weight | 225.07 g/mol |
| LogP | 0.5 |
| Topological Polar Surface Area | 95.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 225.07495 |
| Heavy Atoms | 16 |
| Complexity | 379.0 |
Chemical Identifiers
| CAS Number | 1595-18-2 |
|---|---|
| SMILES | C1CCC(C1)N2C=C(C(=O)NC2=O)[N+](=O)[O-] |
| InChIKey | MCEFQKMAFHXHKA-UHFFFAOYSA-N |
Product Overview
N(1)-Cyclopentyl-5-nitropyrimidine-2,4-dione (CAS 1595-18-2), with molecular formula C9H11N3O4 and molecular weight 225.07 g/mol. IUPAC: 1-cyclopentyl-5-nitropyrimidine-2,4-dione.
Chemical Property Profile of N(1)-Cyclopentyl-5-nitropyrimidine-2,4-dione
Property Insights of N(1)-Cyclopentyl-5-nitropyrimidine-2,4-dione
The XLogP value of 0.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N(1)-Cyclopentyl-5-nitropyrimidine-2,4-dione. The TPSA of 95.2 Ų falls within the moderate polarity range, balancing permeability and solubility for N(1)-Cyclopentyl-5-nitropyrimidine-2,4-dione. Following Lipinski's Rule of Five, N(1)-Cyclopentyl-5-nitropyrimidine-2,4-dione has 1 hydrogen bond donor(s) and 4 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(1)-Cyclopentyl-5-nitropyrimidine-2,4-dione?
The CAS number of N(1)-Cyclopentyl-5-nitropyrimidine-2,4-dione is 1595-18-2.
What is the molecular formula of N(1)-Cyclopentyl-5-nitropyrimidine-2,4-dione?
The molecular formula of N(1)-Cyclopentyl-5-nitropyrimidine-2,4-dione is C9H11N3O4.
What is the molecular weight of N(1)-Cyclopentyl-5-nitropyrimidine-2,4-dione?
The molecular weight of N(1)-Cyclopentyl-5-nitropyrimidine-2,4-dione is 225.07 g/mol.
Where can I buy N(1)-Cyclopentyl-5-nitropyrimidine-2,4-dione?
You can request a quote for N(1)-Cyclopentyl-5-nitropyrimidine-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 N(1)-Cyclopentyl-5-nitropyrimidine-2,4-dione?
Yes, KEHONG BIO provides custom synthesis services for N(1)-Cyclopentyl-5-nitropyrimidine-2,4-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.