BAS 00409316
TL;DR: BAS 00409316 (CAS 331439-53-3) is a chemical compound with molecular formula C25H25N3O2 and molecular weight 399.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(E)-[4-oxo-4-(5,6,7,8-tetrahydronaphthalen-1-ylamino)butan-2-ylidene]amino]naphthalene-1-carboxamide
Also Known As: BAS 00409316, 3-(2-(1-Naphthoyl)hydrazono)-N-(5,6,7,8-tetrahydronaphthalen-1-yl)butanamide, 3-[(Naphthalene-1-carbonyl)-hydrazono]-N-(5,6,7,8-tetrahydro-naphthalen-1-yl)-butyramide, (3E)-3-methyl-4-(naphthylcarbonylamino)-N-(5,6,7,8-tetrahydronaphthyl)-4-azabu t-3-enamide
| Molecular Formula | C25H25N3O2 |
|---|---|
| Molecular Weight | 399.19 g/mol |
| LogP | 4.8531 |
| Topological Polar Surface Area | 70.56 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 399.19467 |
| Heavy Atoms | 30 |
| Complexity | 1128.9468 |
Chemical Identifiers
| CAS Number | 331439-53-3 |
|---|---|
| SMILES | C/C(=N\NC(=O)C1=CC=CC2=CC=CC=C21)/CC(=O)NC3=CC=CC4=C3CCCC4 |
Product Overview
BAS 00409316 (CAS 331439-53-3), with molecular formula C25H25N3O2 and molecular weight 399.19 g/mol. IUPAC: N-[(E)-[4-oxo-4-(5,6,7,8-tetrahydronaphthalen-1-ylamino)butan-2-ylidene]amino]naphthalene-1-carboxamide.
Chemical Property Profile of BAS 00409316
Property Insights of BAS 00409316
The XLogP value of 4.8531 indicates that BAS 00409316 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 70.56 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 00409316. Following Lipinski's Rule of Five, BAS 00409316 has 2 hydrogen bond donor(s) and 3 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 00409316?
The CAS number of BAS 00409316 is 331439-53-3.
What is the molecular formula of BAS 00409316?
The molecular formula of BAS 00409316 is C25H25N3O2.
What is the molecular weight of BAS 00409316?
The molecular weight of BAS 00409316 is 399.19 g/mol.
Where can I buy BAS 00409316?
You can request a quote for BAS 00409316 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00409316?
Yes, KEHONG BIO provides custom synthesis services for BAS 00409316 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.