BIM-0042572.P001
TL;DR: BIM-0042572.P001 (CAS 301688-11-9) is a chemical compound with molecular formula C15H18N6O5 and molecular weight 362.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(E)-(2,3-dimethoxyphenyl)methylideneamino]-3-[(3,5-dioxo-2H-1,2,4-triazin-6-yl)amino]propanamide
Also Known As: BIM-0042572.P001, (E)-N'-(2,3-Dimethoxybenzylidene)-3-((3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazin-6-yl)amino)propanehydrazide, 3-[(3,5-dihydroxy-1,2,4-triazin-6-yl)amino]-N'-[(E)-(2,3-dimethoxyphenyl)methylidene]propanehydrazide (non-preferred name), N'-(2,3-dimethoxybenzylidene)-3-[(3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazin-6-yl)amino]propanohydrazide (non-preferred name), N'-[(E)-(2,3-dimethoxyphenyl)methylidene]-3-[(3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazin-6-yl)amino]propanohydrazide
| Molecular Formula | C15H18N6O5 |
|---|---|
| Molecular Weight | 362.13 g/mol |
| LogP | -0.5723 |
| Topological Polar Surface Area | 150.56 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 8 |
| Exact Mass | 362.13388 |
| Heavy Atoms | 26 |
| Complexity | 903.8854 |
Chemical Identifiers
| CAS Number | 301688-11-9 |
|---|---|
| SMILES | COC1=CC=CC(=C1OC)/C=N/NC(=O)CCNC2=NNC(=O)NC2=O |
Product Overview
BIM-0042572.P001 (CAS 301688-11-9), with molecular formula C15H18N6O5 and molecular weight 362.13 g/mol. IUPAC: N-[(E)-(2,3-dimethoxyphenyl)methylideneamino]-3-[(3,5-dioxo-2H-1,2,4-triazin-6-yl)amino]propanamide.
Chemical Property Profile of BIM-0042572.P001
Property Insights of BIM-0042572.P001
The XLogP value of -0.5723 indicates that BIM-0042572.P001 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 150.56 Ų indicates high polarity, suggesting BIM-0042572.P001 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, BIM-0042572.P001 has 4 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 BIM-0042572.P001?
The CAS number of BIM-0042572.P001 is 301688-11-9.
What is the molecular formula of BIM-0042572.P001?
The molecular formula of BIM-0042572.P001 is C15H18N6O5.
What is the molecular weight of BIM-0042572.P001?
The molecular weight of BIM-0042572.P001 is 362.13 g/mol.
Where can I buy BIM-0042572.P001?
You can request a quote for BIM-0042572.P001 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BIM-0042572.P001?
Yes, KEHONG BIO provides custom synthesis services for BIM-0042572.P001 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.