6-Chloro-N2-heptyl-1,3,5-triazine-2,4-diamine
TL;DR: 6-Chloro-N2-heptyl-1,3,5-triazine-2,4-diamine (CAS 76893-55-5) is a chemical compound with molecular formula C10H18ClN5 and molecular weight 243.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-chloro-2-N-heptyl-1,3,5-triazine-2,4-diamine
Also Known As: 6-chloro-n-heptyl-1,3,5-triazine-2,4-diamine, 6-CHLORO-N2-HEPTYL-1,3,5-TRIAZINE-2,4-DIAMINE, Butyl-bis-<2-hydroxy-naphthyl-(1)-methyl>-amin, 6-chloro-2-N-heptyl-1,3,5-triazine-2,4-diamine, 6-Chloro-N~2~-heptyl-1,3,5-triazine-2,4(1H,3H)-diimine
| Molecular Formula | C10H18ClN5 |
|---|---|
| Molecular Weight | 243.13 g/mol |
| LogP | 3.8 |
| Topological Polar Surface Area | 76.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 243.12508 |
| Heavy Atoms | 16 |
| Complexity | 181.0 |
Chemical Identifiers
| CAS Number | 76893-55-5 |
|---|---|
| SMILES | CCCCCCCNC1=NC(=NC(=N1)N)Cl |
| InChIKey | BKDHMBVCFDTRLX-UHFFFAOYSA-N |
Product Overview
6-Chloro-N2-heptyl-1,3,5-triazine-2,4-diamine (CAS 76893-55-5), with molecular formula C10H18ClN5 and molecular weight 243.13 g/mol. IUPAC: 6-chloro-2-N-heptyl-1,3,5-triazine-2,4-diamine.
Chemical Property Profile of 6-Chloro-N2-heptyl-1,3,5-triazine-2,4-diamine
Property Insights of 6-Chloro-N2-heptyl-1,3,5-triazine-2,4-diamine
The XLogP value of 3.8 indicates that 6-Chloro-N2-heptyl-1,3,5-triazine-2,4-diamine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 76.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 6-Chloro-N2-heptyl-1,3,5-triazine-2,4-diamine. Following Lipinski's Rule of Five, 6-Chloro-N2-heptyl-1,3,5-triazine-2,4-diamine has 2 hydrogen bond donor(s) and 5 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-Chloro-N2-heptyl-1,3,5-triazine-2,4-diamine?
The CAS number of 6-Chloro-N2-heptyl-1,3,5-triazine-2,4-diamine is 76893-55-5.
What is the molecular formula of 6-Chloro-N2-heptyl-1,3,5-triazine-2,4-diamine?
The molecular formula of 6-Chloro-N2-heptyl-1,3,5-triazine-2,4-diamine is C10H18ClN5.
What is the molecular weight of 6-Chloro-N2-heptyl-1,3,5-triazine-2,4-diamine?
The molecular weight of 6-Chloro-N2-heptyl-1,3,5-triazine-2,4-diamine is 243.13 g/mol.
Where can I buy 6-Chloro-N2-heptyl-1,3,5-triazine-2,4-diamine?
You can request a quote for 6-Chloro-N2-heptyl-1,3,5-triazine-2,4-diamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-Chloro-N2-heptyl-1,3,5-triazine-2,4-diamine?
Yes, KEHONG BIO provides custom synthesis services for 6-Chloro-N2-heptyl-1,3,5-triazine-2,4-diamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.