6-amino-1-benzyl-5-(2-chloroacetyl)-3-ethyl-1,2,3,4-tetrahydropyrimidine-2,4-dione
TL;DR: 6-amino-1-benzyl-5-(2-chloroacetyl)-3-ethyl-1,2,3,4-tetrahydropyrimidine-2,4-dione (CAS 568543-68-0) is a chemical compound with molecular formula C15H16ClN3O3 and molecular weight 321.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-amino-1-benzyl-5-(2-chloroacetyl)-3-ethylpyrimidine-2,4-dione
Also Known As: 6-amino-1-benzyl-5-(2-chloroacetyl)-3-ethyl-1,2,3,4-tetrahydropyrimidine-2,4-dione, 6-Amino-1-benzyl-5-(2-chloro-acetyl)-3-ethyl-1H-pyrimidine-2,4-dione, 6-amino-1-benzyl-5-(2-chloroacetyl)-3-ethylpyrimidine-2,4-dione, 6-Amino-1-benzyl-5-(chloroacetyl)-3-ethylpyrimidine-2,4(1H,3H)-dione, 6-Amino-5-(2-chloroacetyl)-3-ethyl-1-(phenylmethyl)-2,4(1H,3H)-pyrimidinedione
| Molecular Formula | C15H16ClN3O3 |
|---|---|
| Molecular Weight | 321.09 g/mol |
| LogP | 1.0819 |
| Topological Polar Surface Area | 87.09 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 321.088 |
| Heavy Atoms | 22 |
| Complexity | 809.2629 |
Chemical Identifiers
| CAS Number | 568543-68-0 |
|---|---|
| SMILES | CCN1C(=O)C(=C(N(C1=O)CC2=CC=CC=C2)N)C(=O)CCl |
Product Overview
6-amino-1-benzyl-5-(2-chloroacetyl)-3-ethyl-1,2,3,4-tetrahydropyrimidine-2,4-dione (CAS 568543-68-0), with molecular formula C15H16ClN3O3 and molecular weight 321.09 g/mol. IUPAC: 6-amino-1-benzyl-5-(2-chloroacetyl)-3-ethylpyrimidine-2,4-dione.
Chemical Property Profile of 6-amino-1-benzyl-5-(2-chloroacetyl)-3-ethyl-1,2,3,4-tetrahydropyrimidine-2,4-dione
Property Insights of 6-amino-1-benzyl-5-(2-chloroacetyl)-3-ethyl-1,2,3,4-tetrahydropyrimidine-2,4-dione
The XLogP value of 1.0819 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6-amino-1-benzyl-5-(2-chloroacetyl)-3-ethyl-1,2,3,4-tetrahydropyrimidine-2,4-dione. The TPSA of 87.09 Ų falls within the moderate polarity range, balancing permeability and solubility for 6-amino-1-benzyl-5-(2-chloroacetyl)-3-ethyl-1,2,3,4-tetrahydropyrimidine-2,4-dione. Following Lipinski's Rule of Five, 6-amino-1-benzyl-5-(2-chloroacetyl)-3-ethyl-1,2,3,4-tetrahydropyrimidine-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 6-amino-1-benzyl-5-(2-chloroacetyl)-3-ethyl-1,2,3,4-tetrahydropyrimidine-2,4-dione?
The CAS number of 6-amino-1-benzyl-5-(2-chloroacetyl)-3-ethyl-1,2,3,4-tetrahydropyrimidine-2,4-dione is 568543-68-0.
What is the molecular formula of 6-amino-1-benzyl-5-(2-chloroacetyl)-3-ethyl-1,2,3,4-tetrahydropyrimidine-2,4-dione?
The molecular formula of 6-amino-1-benzyl-5-(2-chloroacetyl)-3-ethyl-1,2,3,4-tetrahydropyrimidine-2,4-dione is C15H16ClN3O3.
What is the molecular weight of 6-amino-1-benzyl-5-(2-chloroacetyl)-3-ethyl-1,2,3,4-tetrahydropyrimidine-2,4-dione?
The molecular weight of 6-amino-1-benzyl-5-(2-chloroacetyl)-3-ethyl-1,2,3,4-tetrahydropyrimidine-2,4-dione is 321.09 g/mol.
Where can I buy 6-amino-1-benzyl-5-(2-chloroacetyl)-3-ethyl-1,2,3,4-tetrahydropyrimidine-2,4-dione?
You can request a quote for 6-amino-1-benzyl-5-(2-chloroacetyl)-3-ethyl-1,2,3,4-tetrahydropyrimidine-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-amino-1-benzyl-5-(2-chloroacetyl)-3-ethyl-1,2,3,4-tetrahydropyrimidine-2,4-dione?
Yes, KEHONG BIO provides custom synthesis services for 6-amino-1-benzyl-5-(2-chloroacetyl)-3-ethyl-1,2,3,4-tetrahydropyrimidine-2,4-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.