![6-{[(3-Chlorophenyl)methyl]amino}pyrimidine-2,4(1H,3H)-dione structure](/static/products/1760/17606-65-4.webp)
6-{[(3-Chlorophenyl)methyl]amino}pyrimidine-2,4(1H,3H)-dione
TL;DR: 6-{[(3-Chlorophenyl)methyl]amino}pyrimidine-2,4(1H,3H)-dione (CAS 17606-65-4) is a chemical compound with molecular formula C11H10ClN3O2 and molecular weight 251.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-[(3-chlorophenyl)methylamino]-1H-pyrimidine-2,4-dione
Also Known As: 6-(3-chloro-benzylamino)-1H-pyrimidine-2,4-dione, 6-{[(3-Chlorophenyl)methyl]amino}pyrimidine-2,4(1H,3H)-dione, 6-[(3-chlorophenyl)methylamino]-1H-pyrimidine-2,4-dione
| Molecular Formula | C11H10ClN3O2 |
|---|---|
| Molecular Weight | 251.05 g/mol |
| LogP | 1.3 |
| Topological Polar Surface Area | 70.2 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 251.04616 |
| Heavy Atoms | 17 |
| Complexity | 357.0 |
Chemical Identifiers
| CAS Number | 17606-65-4 |
|---|---|
| SMILES | C1=CC(=CC(=C1)Cl)CNC2=CC(=O)NC(=O)N2 |
| InChIKey | OHHODSZHMONXBH-UHFFFAOYSA-N |
Product Overview
6-{[(3-Chlorophenyl)methyl]amino}pyrimidine-2,4(1H,3H)-dione (CAS 17606-65-4), with molecular formula C11H10ClN3O2 and molecular weight 251.05 g/mol. IUPAC: 6-[(3-chlorophenyl)methylamino]-1H-pyrimidine-2,4-dione.
Chemical Property Profile of 6-{[(3-Chlorophenyl)methyl]amino}pyrimidine-2,4(1H,3H)-dione
Property Insights of 6-{[(3-Chlorophenyl)methyl]amino}pyrimidine-2,4(1H,3H)-dione
The XLogP value of 1.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6-{[(3-Chlorophenyl)methyl]amino}pyrimidine-2,4(1H,3H)-dione. The TPSA of 70.2 Ų falls within the moderate polarity range, balancing permeability and solubility for 6-{[(3-Chlorophenyl)methyl]amino}pyrimidine-2,4(1H,3H)-dione. Following Lipinski's Rule of Five, 6-{[(3-Chlorophenyl)methyl]amino}pyrimidine-2,4(1H,3H)-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-{[(3-Chlorophenyl)methyl]amino}pyrimidine-2,4(1H,3H)-dione?
The CAS number of 6-{[(3-Chlorophenyl)methyl]amino}pyrimidine-2,4(1H,3H)-dione is 17606-65-4.
What is the molecular formula of 6-{[(3-Chlorophenyl)methyl]amino}pyrimidine-2,4(1H,3H)-dione?
The molecular formula of 6-{[(3-Chlorophenyl)methyl]amino}pyrimidine-2,4(1H,3H)-dione is C11H10ClN3O2.
What is the molecular weight of 6-{[(3-Chlorophenyl)methyl]amino}pyrimidine-2,4(1H,3H)-dione?
The molecular weight of 6-{[(3-Chlorophenyl)methyl]amino}pyrimidine-2,4(1H,3H)-dione is 251.05 g/mol.
Where can I buy 6-{[(3-Chlorophenyl)methyl]amino}pyrimidine-2,4(1H,3H)-dione?
You can request a quote for 6-{[(3-Chlorophenyl)methyl]amino}pyrimidine-2,4(1H,3H)-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-{[(3-Chlorophenyl)methyl]amino}pyrimidine-2,4(1H,3H)-dione?
Yes, KEHONG BIO provides custom synthesis services for 6-{[(3-Chlorophenyl)methyl]amino}pyrimidine-2,4(1H,3H)-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.