BAS 12814258
TL;DR: BAS 12814258 (CAS 827006-46-2) is a chemical compound with molecular formula C22H27N7O2 and molecular weight 421.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-N-(3-methoxyphenyl)-6-[[4-(4-methoxyphenyl)piperazin-1-yl]methyl]-1,3,5-triazine-2,4-diamine
Also Known As: BAS 12814258, N-(3-methoxyphenyl)-6-{[4-(4-methoxyphenyl)piperazin-1-yl]methyl}-1,3,5-triazine-2,4-diamine, 2-N-(3-methoxyphenyl)-6-[[4-(4-methoxyphenyl)piperazin-1-yl]methyl]-1,3,5-triazine-2,4-diamine, (4-amino-6-{[4-(4-methoxyphenyl)piperazinyl]methyl}(1,3,5-triazin-2-yl))(3-met hoxyphenyl)amine, N-(4-amino-6-{[4-(4-methoxyphenyl)-1-piperazinyl]methyl}-1,3,5-triazin-2-yl)-N-(3-methoxyphenyl)amine
| Molecular Formula | C22H27N7O2 |
|---|---|
| Molecular Weight | 421.22 g/mol |
| LogP | 2.5368 |
| Topological Polar Surface Area | 101.66 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 7 |
| Exact Mass | 421.22263 |
| Heavy Atoms | 31 |
| Complexity | 1004.99615 |
Chemical Identifiers
| CAS Number | 827006-46-2 |
|---|---|
| SMILES | COC1=CC=C(C=C1)N2CCN(CC2)CC3=NC(=NC(=N3)NC4=CC(=CC=C4)OC)N |
Product Overview
BAS 12814258 (CAS 827006-46-2), with molecular formula C22H27N7O2 and molecular weight 421.22 g/mol. IUPAC: 2-N-(3-methoxyphenyl)-6-[[4-(4-methoxyphenyl)piperazin-1-yl]methyl]-1,3,5-triazine-2,4-diamine.
Chemical Property Profile of BAS 12814258
Property Insights of BAS 12814258
The XLogP value of 2.5368 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 12814258. The TPSA of 101.66 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 12814258. Following Lipinski's Rule of Five, BAS 12814258 has 2 hydrogen bond donor(s) and 9 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 12814258?
The CAS number of BAS 12814258 is 827006-46-2.
What is the molecular formula of BAS 12814258?
The molecular formula of BAS 12814258 is C22H27N7O2.
What is the molecular weight of BAS 12814258?
The molecular weight of BAS 12814258 is 421.22 g/mol.
Where can I buy BAS 12814258?
You can request a quote for BAS 12814258 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 12814258?
Yes, KEHONG BIO provides custom synthesis services for BAS 12814258 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.