6-Pentylamino-1H-pyrimidine-2,4-dione
TL;DR: 6-Pentylamino-1H-pyrimidine-2,4-dione (CAS 28484-87-9) is a chemical compound with molecular formula C9H15N3O2 and molecular weight 197.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-(pentylamino)-1H-pyrimidine-2,4-dione
Also Known As: 6-(n-pentylamino)uracil, 6-Pentylamino-1H-pyrimidine-2,4-dione, 6-(pentylamino)-1H-pyrimidine-2,4-dione, 6-(Pentylamino)pyrimidine-2,4(1H,3H)-dione
| Molecular Formula | C9H15N3O2 |
|---|---|
| Molecular Weight | 197.12 g/mol |
| LogP | 1.0 |
| Topological Polar Surface Area | 70.2 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 197.11642 |
| Heavy Atoms | 14 |
| Complexity | 261.0 |
Chemical Identifiers
| CAS Number | 28484-87-9 |
|---|---|
| SMILES | CCCCCNC1=CC(=O)NC(=O)N1 |
| InChIKey | ZUBHNBOPGWNUMZ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
6-Pentylamino-1H-pyrimidine-2,4-dione (CAS 28484-87-9), with molecular formula C9H15N3O2 and molecular weight 197.12 g/mol. IUPAC: 6-(pentylamino)-1H-pyrimidine-2,4-dione.
Chemical Property Profile of 6-Pentylamino-1H-pyrimidine-2,4-dione
Property Insights of 6-Pentylamino-1H-pyrimidine-2,4-dione
The XLogP value of 1.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6-Pentylamino-1H-pyrimidine-2,4-dione. The TPSA of 70.2 Ų falls within the moderate polarity range, balancing permeability and solubility for 6-Pentylamino-1H-pyrimidine-2,4-dione. Following Lipinski's Rule of Five, 6-Pentylamino-1H-pyrimidine-2,4-dione has 3 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 6-Pentylamino-1H-pyrimidine-2,4-dione?
The CAS number of 6-Pentylamino-1H-pyrimidine-2,4-dione is 28484-87-9.
What is the molecular formula of 6-Pentylamino-1H-pyrimidine-2,4-dione?
The molecular formula of 6-Pentylamino-1H-pyrimidine-2,4-dione is C9H15N3O2.
What is the molecular weight of 6-Pentylamino-1H-pyrimidine-2,4-dione?
The molecular weight of 6-Pentylamino-1H-pyrimidine-2,4-dione is 197.12 g/mol.
Where can I buy 6-Pentylamino-1H-pyrimidine-2,4-dione?
You can request a quote for 6-Pentylamino-1H-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-Pentylamino-1H-pyrimidine-2,4-dione?
Yes, KEHONG BIO provides custom synthesis services for 6-Pentylamino-1H-pyrimidine-2,4-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.