BAS 12814286
TL;DR: BAS 12814286 (CAS 827007-91-0) is a chemical compound with molecular formula C21H24FN7O and molecular weight 409.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-[[4-(4-fluorophenyl)piperazin-1-yl]methyl]-2-N-(3-methoxyphenyl)-1,3,5-triazine-2,4-diamine
Also Known As: BAS 12814286, 6-{[4-(4-fluorophenyl)piperazin-1-yl]methyl}-N-(3-methoxyphenyl)-1,3,5-triazine-2,4-diamine, (4-amino-6-{[4-(4-fluorophenyl)piperazinyl]methyl}(1,3,5-triazin-2-yl))(3-meth oxyphenyl)amine, 6-((4-(4-fluorophenyl)piperazin-1-yl)methyl)-N2-(3-methoxyphenyl)-1,3,5-triazine-2,4-diamine, 6-[[4-(4-fluorophenyl)piperazin-1-yl]methyl]-2-N-(3-methoxyphenyl)-1,3,5-triazine-2,4-diamine
| Molecular Formula | C21H24FN7O |
|---|---|
| Molecular Weight | 409.20 g/mol |
| LogP | 2.6673 |
| Topological Polar Surface Area | 92.43 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 6 |
| Exact Mass | 409.20264 |
| Heavy Atoms | 30 |
| Complexity | 990.89996 |
Chemical Identifiers
| CAS Number | 827007-91-0 |
|---|---|
| SMILES | COC1=CC=CC(=C1)NC2=NC(=NC(=N2)N)CN3CCN(CC3)C4=CC=C(C=C4)F |
Product Overview
BAS 12814286 (CAS 827007-91-0), with molecular formula C21H24FN7O and molecular weight 409.20 g/mol. IUPAC: 6-[[4-(4-fluorophenyl)piperazin-1-yl]methyl]-2-N-(3-methoxyphenyl)-1,3,5-triazine-2,4-diamine.
Chemical Property Profile of BAS 12814286
Property Insights of BAS 12814286
The XLogP value of 2.6673 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 12814286. The TPSA of 92.43 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 12814286. Following Lipinski's Rule of Five, BAS 12814286 has 2 hydrogen bond donor(s) and 8 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 BAS 12814286?
The CAS number of BAS 12814286 is 827007-91-0.
What is the molecular formula of BAS 12814286?
The molecular formula of BAS 12814286 is C21H24FN7O.
What is the molecular weight of BAS 12814286?
The molecular weight of BAS 12814286 is 409.20 g/mol.
Where can I buy BAS 12814286?
You can request a quote for BAS 12814286 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 12814286?
Yes, KEHONG BIO provides custom synthesis services for BAS 12814286 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.