1H-Azepine, 1-(4,6-dichloro-1,3,5-triazin-2-yl)hexahydro-
TL;DR: 1H-Azepine, 1-(4,6-dichloro-1,3,5-triazin-2-yl)hexahydro- (CAS 98185-17-2) is a chemical compound with molecular formula C9H12Cl2N4 and molecular weight 246.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4,6-dichloro-1,3,5-triazin-2-yl)azepane
Also Known As: 1-(4,6-dichloro-1,3,5-triazin-2-yl)azepane, 2,4-Dichloro-6-(hexahydro-1-azepinyl)-s-triazine, s-Triazine, 2,4-dichloro-6-(hexahydro-1-azepinyl), 1H-Azepine, 1-(4,6-dichloro-1,3,5-triazin-2-yl)hexahydro-, 1-(4,6-dichloro-1,3,5-triazin-2-yl)hexahydro-1H-Azepine
| Molecular Formula | C9H12Cl2N4 |
|---|---|
| Molecular Weight | 246.04 g/mol |
| LogP | 2.5588 |
| Topological Polar Surface Area | 41.91 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 246.0439 |
| Heavy Atoms | 15 |
| Complexity | 316.63428 |
Chemical Identifiers
| CAS Number | 98185-17-2 |
|---|---|
| SMILES | C1CCCN(CC1)C2=NC(=NC(=N2)Cl)Cl |
Product Overview
1H-Azepine, 1-(4,6-dichloro-1,3,5-triazin-2-yl)hexahydro- (CAS 98185-17-2), with molecular formula C9H12Cl2N4 and molecular weight 246.04 g/mol. IUPAC: 1-(4,6-dichloro-1,3,5-triazin-2-yl)azepane.
Chemical Property Profile of 1H-Azepine, 1-(4,6-dichloro-1,3,5-triazin-2-yl)hexahydro-
Property Insights of 1H-Azepine, 1-(4,6-dichloro-1,3,5-triazin-2-yl)hexahydro-
The XLogP value of 2.5588 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1H-Azepine, 1-(4,6-dichloro-1,3,5-triazin-2-yl)hexahydro-. With a topological polar surface area (TPSA) of 41.91 Ų, 1H-Azepine, 1-(4,6-dichloro-1,3,5-triazin-2-yl)hexahydro- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1H-Azepine, 1-(4,6-dichloro-1,3,5-triazin-2-yl)hexahydro- has 0 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 1H-Azepine, 1-(4,6-dichloro-1,3,5-triazin-2-yl)hexahydro-?
The CAS number of 1H-Azepine, 1-(4,6-dichloro-1,3,5-triazin-2-yl)hexahydro- is 98185-17-2.
What is the molecular formula of 1H-Azepine, 1-(4,6-dichloro-1,3,5-triazin-2-yl)hexahydro-?
The molecular formula of 1H-Azepine, 1-(4,6-dichloro-1,3,5-triazin-2-yl)hexahydro- is C9H12Cl2N4.
What is the molecular weight of 1H-Azepine, 1-(4,6-dichloro-1,3,5-triazin-2-yl)hexahydro-?
The molecular weight of 1H-Azepine, 1-(4,6-dichloro-1,3,5-triazin-2-yl)hexahydro- is 246.04 g/mol.
Where can I buy 1H-Azepine, 1-(4,6-dichloro-1,3,5-triazin-2-yl)hexahydro-?
You can request a quote for 1H-Azepine, 1-(4,6-dichloro-1,3,5-triazin-2-yl)hexahydro- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1H-Azepine, 1-(4,6-dichloro-1,3,5-triazin-2-yl)hexahydro-?
Yes, KEHONG BIO provides custom synthesis services for 1H-Azepine, 1-(4,6-dichloro-1,3,5-triazin-2-yl)hexahydro- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.