BAS 00336218
TL;DR: BAS 00336218 (CAS 331463-85-5) is a chemical compound with molecular formula C19H23I2N7O3 and molecular weight 651.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(E)-(3,5-diiodo-2-methoxyphenyl)methylideneamino]-4,6-dimorpholin-4-yl-1,3,5-triazin-2-amine
Also Known As: BAS 00336218, 3,5-diiodo-2-methoxybenzaldehyde [4,6-di(4-morpholinyl)-1,3,5-triazin-2-yl]hydrazone, N-[(E)-(3,5-diiodo-2-methoxyphenyl)methylideneamino]-4,6-dimorpholin-4-yl-1,3,5-triazin-2-amine
| Molecular Formula | C19H23I2N7O3 |
|---|---|
| Molecular Weight | 651.00 g/mol |
| LogP | 2.2086 |
| Topological Polar Surface Area | 97.23 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 6 |
| Exact Mass | 650.9952 |
| Heavy Atoms | 31 |
| Complexity | 898.7077 |
Chemical Identifiers
| CAS Number | 331463-85-5 |
|---|---|
| SMILES | COC1=C(C=C(C=C1I)I)/C=N/NC2=NC(=NC(=N2)N3CCOCC3)N4CCOCC4 |
Product Overview
BAS 00336218 (CAS 331463-85-5), with molecular formula C19H23I2N7O3 and molecular weight 651.00 g/mol. IUPAC: N-[(E)-(3,5-diiodo-2-methoxyphenyl)methylideneamino]-4,6-dimorpholin-4-yl-1,3,5-triazin-2-amine.
Chemical Property Profile of BAS 00336218
Property Insights of BAS 00336218
The XLogP value of 2.2086 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 00336218. The TPSA of 97.23 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 00336218. Following Lipinski's Rule of Five, BAS 00336218 has 1 hydrogen bond donor(s) and 10 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of BAS 00336218?
The CAS number of BAS 00336218 is 331463-85-5.
What is the molecular formula of BAS 00336218?
The molecular formula of BAS 00336218 is C19H23I2N7O3.
What is the molecular weight of BAS 00336218?
The molecular weight of BAS 00336218 is 651.00 g/mol.
Where can I buy BAS 00336218?
You can request a quote for BAS 00336218 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00336218?
Yes, KEHONG BIO provides custom synthesis services for BAS 00336218 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.