![2-Chloro-1-[4-(4,6-diamino-2,2-dimethyl-1,3,5-triazin-1-yl)phenyl]ethanone structure](/static/products/1016/10161-69-0.webp)
2-Chloro-1-[4-(4,6-diamino-2,2-dimethyl-1,3,5-triazin-1-yl)phenyl]ethanone
TL;DR: 2-Chloro-1-[4-(4,6-diamino-2,2-dimethyl-1,3,5-triazin-1-yl)phenyl]ethanone (CAS 10161-69-0) is a chemical compound with molecular formula C13H16ClN5O and molecular weight 293.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-chloro-1-[4-(4,6-diamino-2,2-dimethyl-1,3,5-triazin-1-yl)phenyl]ethanone
Also Known As: 2-chloro-1-[4-(4,6-diamino-2,2-dimethyl-1,3,5-triazin-1-yl)phenyl]ethanone, 2-chloro-1-[4-(4,6-diamino-2,2-dimethyl-1,3,5-triazin-1-yl)p, 2,4-Diamino-6,6-dimethyl-5,6-dihydro-5-(4-chloroacetylphenyl)-1,3,5-triazine, 2-Chloro-1-[4-(4,6-diamino-2,2-dimethyl-1,3,5-triazin-1(2H)-yl)phenyl]ethan-1-one, 2-chloro-1-[4-(4,6-diamino-2,2-dimethyl-1,2-dihydro-1,3,5-triazin-1-yl)phenyl]ethan-1-one
| Molecular Formula | C13H16ClN5O |
|---|---|
| Molecular Weight | 293.10 g/mol |
| LogP | 0.6 |
| Topological Polar Surface Area | 97.1 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 293.10434 |
| Heavy Atoms | 20 |
| Complexity | 452.0 |
Chemical Identifiers
| CAS Number | 10161-69-0 |
|---|---|
| SMILES | CC1(N=C(N=C(N1C2=CC=C(C=C2)C(=O)CCl)N)N)C |
| InChIKey | RAARAFJMLCLIJT-UHFFFAOYSA-N |
Product Overview
2-Chloro-1-[4-(4,6-diamino-2,2-dimethyl-1,3,5-triazin-1-yl)phenyl]ethanone (CAS 10161-69-0), with molecular formula C13H16ClN5O and molecular weight 293.10 g/mol. IUPAC: 2-chloro-1-[4-(4,6-diamino-2,2-dimethyl-1,3,5-triazin-1-yl)phenyl]ethanone.
Chemical Property Profile of 2-Chloro-1-[4-(4,6-diamino-2,2-dimethyl-1,3,5-triazin-1-yl)phenyl]ethanone
Property Insights of 2-Chloro-1-[4-(4,6-diamino-2,2-dimethyl-1,3,5-triazin-1-yl)phenyl]ethanone
The XLogP value of 0.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Chloro-1-[4-(4,6-diamino-2,2-dimethyl-1,3,5-triazin-1-yl)phenyl]ethanone. The TPSA of 97.1 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Chloro-1-[4-(4,6-diamino-2,2-dimethyl-1,3,5-triazin-1-yl)phenyl]ethanone. Following Lipinski's Rule of Five, 2-Chloro-1-[4-(4,6-diamino-2,2-dimethyl-1,3,5-triazin-1-yl)phenyl]ethanone has 2 hydrogen bond donor(s) and 2 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 2-Chloro-1-[4-(4,6-diamino-2,2-dimethyl-1,3,5-triazin-1-yl)phenyl]ethanone?
The CAS number of 2-Chloro-1-[4-(4,6-diamino-2,2-dimethyl-1,3,5-triazin-1-yl)phenyl]ethanone is 10161-69-0.
What is the molecular formula of 2-Chloro-1-[4-(4,6-diamino-2,2-dimethyl-1,3,5-triazin-1-yl)phenyl]ethanone?
The molecular formula of 2-Chloro-1-[4-(4,6-diamino-2,2-dimethyl-1,3,5-triazin-1-yl)phenyl]ethanone is C13H16ClN5O.
What is the molecular weight of 2-Chloro-1-[4-(4,6-diamino-2,2-dimethyl-1,3,5-triazin-1-yl)phenyl]ethanone?
The molecular weight of 2-Chloro-1-[4-(4,6-diamino-2,2-dimethyl-1,3,5-triazin-1-yl)phenyl]ethanone is 293.10 g/mol.
Where can I buy 2-Chloro-1-[4-(4,6-diamino-2,2-dimethyl-1,3,5-triazin-1-yl)phenyl]ethanone?
You can request a quote for 2-Chloro-1-[4-(4,6-diamino-2,2-dimethyl-1,3,5-triazin-1-yl)phenyl]ethanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Chloro-1-[4-(4,6-diamino-2,2-dimethyl-1,3,5-triazin-1-yl)phenyl]ethanone?
Yes, KEHONG BIO provides custom synthesis services for 2-Chloro-1-[4-(4,6-diamino-2,2-dimethyl-1,3,5-triazin-1-yl)phenyl]ethanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.