6-(Naphthalen-1-ylamino)-1H-pyrimidine-2,4-dione
TL;DR: 6-(Naphthalen-1-ylamino)-1H-pyrimidine-2,4-dione (CAS 21333-08-4) is a chemical compound with molecular formula C14H11N3O2 and molecular weight 253.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-(naphthalen-1-ylamino)-1H-pyrimidine-2,4-dione
Also Known As: 6-(d-naphthylamino)uracil, 6-(Naphthalen-1-ylamino)-1H-pyrimidine-2,4-dione, 6-(Naphthalen-1-ylamino)pyrimidine-2,4(1H,3H)-dione, 6-naphthalen-1-ylamino-1H-pyrimidine-2,4-dione, 6-[(Naphthalen-1-yl)amino]pyrimidine-2,4(1H,3H)-dione
| Molecular Formula | C14H11N3O2 |
|---|---|
| Molecular Weight | 253.09 g/mol |
| LogP | 2.0 |
| Topological Polar Surface Area | 70.2 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 253.08513 |
| Heavy Atoms | 19 |
| Complexity | 419.0 |
Chemical Identifiers
| CAS Number | 21333-08-4 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C=CC=C2NC3=CC(=O)NC(=O)N3 |
| InChIKey | MBZFANWCRWUDIY-UHFFFAOYSA-N |
Product Overview
6-(Naphthalen-1-ylamino)-1H-pyrimidine-2,4-dione (CAS 21333-08-4), with molecular formula C14H11N3O2 and molecular weight 253.09 g/mol. IUPAC: 6-(naphthalen-1-ylamino)-1H-pyrimidine-2,4-dione.
Chemical Property Profile of 6-(Naphthalen-1-ylamino)-1H-pyrimidine-2,4-dione
Property Insights of 6-(Naphthalen-1-ylamino)-1H-pyrimidine-2,4-dione
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6-(Naphthalen-1-ylamino)-1H-pyrimidine-2,4-dione. The TPSA of 70.2 Ų falls within the moderate polarity range, balancing permeability and solubility for 6-(Naphthalen-1-ylamino)-1H-pyrimidine-2,4-dione. Following Lipinski's Rule of Five, 6-(Naphthalen-1-ylamino)-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-(Naphthalen-1-ylamino)-1H-pyrimidine-2,4-dione?
The CAS number of 6-(Naphthalen-1-ylamino)-1H-pyrimidine-2,4-dione is 21333-08-4.
What is the molecular formula of 6-(Naphthalen-1-ylamino)-1H-pyrimidine-2,4-dione?
The molecular formula of 6-(Naphthalen-1-ylamino)-1H-pyrimidine-2,4-dione is C14H11N3O2.
What is the molecular weight of 6-(Naphthalen-1-ylamino)-1H-pyrimidine-2,4-dione?
The molecular weight of 6-(Naphthalen-1-ylamino)-1H-pyrimidine-2,4-dione is 253.09 g/mol.
Where can I buy 6-(Naphthalen-1-ylamino)-1H-pyrimidine-2,4-dione?
You can request a quote for 6-(Naphthalen-1-ylamino)-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-(Naphthalen-1-ylamino)-1H-pyrimidine-2,4-dione?
Yes, KEHONG BIO provides custom synthesis services for 6-(Naphthalen-1-ylamino)-1H-pyrimidine-2,4-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.