BAS 00442732
TL;DR: BAS 00442732 (CAS 332401-99-7) is a chemical compound with molecular formula C21H21F2N7 and molecular weight 409.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-N-(4-fluorophenyl)-2-N-[(E)-(2-fluorophenyl)methylideneamino]-6-piperidin-1-yl-1,3,5-triazine-2,4-diamine
Also Known As: BAS 00442732, A1395/0062411, 4-N-(4-fluorophenyl)-2-N-[(E)-(2-fluorophenyl)methylideneamino]-6-piperidin-1-yl-1,3,5-triazine-2,4-diamine, 2-fluorobenzaldehyde [4-(4-fluoroanilino)-6-piperidin-1-yl-1,3,5-triazin-2-yl]hydrazone, 4-[(2E)-2-(2-fluorobenzylidene)hydrazinyl]-N-(4-fluorophenyl)-6-(piperidin-1-yl)-1,3,5-triazin-2-amine
| Molecular Formula | C21H21F2N7 |
|---|---|
| Molecular Weight | 409.18 g/mol |
| LogP | 4.3297 |
| Topological Polar Surface Area | 78.33 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 409.18265 |
| Heavy Atoms | 30 |
| Complexity | 1018.1184 |
Chemical Identifiers
| CAS Number | 332401-99-7 |
|---|---|
| SMILES | C1CCN(CC1)C2=NC(=NC(=N2)N/N=C/C3=CC=CC=C3F)NC4=CC=C(C=C4)F |
Product Overview
BAS 00442732 (CAS 332401-99-7), with molecular formula C21H21F2N7 and molecular weight 409.18 g/mol. IUPAC: 4-N-(4-fluorophenyl)-2-N-[(E)-(2-fluorophenyl)methylideneamino]-6-piperidin-1-yl-1,3,5-triazine-2,4-diamine.
Chemical Property Profile of BAS 00442732
Property Insights of BAS 00442732
The XLogP value of 4.3297 indicates that BAS 00442732 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 78.33 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 00442732. Following Lipinski's Rule of Five, BAS 00442732 has 2 hydrogen bond donor(s) and 7 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 00442732?
The CAS number of BAS 00442732 is 332401-99-7.
What is the molecular formula of BAS 00442732?
The molecular formula of BAS 00442732 is C21H21F2N7.
What is the molecular weight of BAS 00442732?
The molecular weight of BAS 00442732 is 409.18 g/mol.
Where can I buy BAS 00442732?
You can request a quote for BAS 00442732 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00442732?
Yes, KEHONG BIO provides custom synthesis services for BAS 00442732 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.