BIM-0042040.P001
TL;DR: BIM-0042040.P001 (CAS 301688-10-8) is a chemical compound with molecular formula C14H16N6O4 and molecular weight 332.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[(3,5-dioxo-2H-1,2,4-triazin-6-yl)amino]-N-[(E)-(4-methoxyphenyl)methylideneamino]propanamide
Also Known As: BIM-0042040.P001, (E)-3-((3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazin-6-yl)amino)-N'-(4-methoxybenzylidene)propanehydrazide, 3-[(3,5-dihydroxy-1,2,4-triazin-6-yl)amino]-N'-[(E)-(4-methoxyphenyl)methylidene]propanehydrazide (non-preferred name), 3-[(3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazin-6-yl)amino]-N'-(4-methoxybenzylidene)propanohydrazide, 3-[(3,5-DIOXO-2,3,4,5-TETRAHYDRO-1,2,4-TRIAZIN-6-YL)AMINO]-N'-[(E)-(4-METHOXYPHENYL)METHYLIDENE]PROPANEHYDRAZIDE
| Molecular Formula | C14H16N6O4 |
|---|---|
| Molecular Weight | 332.12 g/mol |
| LogP | -0.5809 |
| Topological Polar Surface Area | 141.33 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 7 |
| Exact Mass | 332.1233 |
| Heavy Atoms | 24 |
| Complexity | 824.14856 |
Chemical Identifiers
| CAS Number | 301688-10-8 |
|---|---|
| SMILES | COC1=CC=C(C=C1)/C=N/NC(=O)CCNC2=NNC(=O)NC2=O |
Product Overview
BIM-0042040.P001 (CAS 301688-10-8), with molecular formula C14H16N6O4 and molecular weight 332.12 g/mol. IUPAC: 3-[(3,5-dioxo-2H-1,2,4-triazin-6-yl)amino]-N-[(E)-(4-methoxyphenyl)methylideneamino]propanamide.
Chemical Property Profile of BIM-0042040.P001
Property Insights of BIM-0042040.P001
The XLogP value of -0.5809 indicates that BIM-0042040.P001 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 141.33 Ų indicates high polarity, suggesting BIM-0042040.P001 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, BIM-0042040.P001 has 4 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 BIM-0042040.P001?
The CAS number of BIM-0042040.P001 is 301688-10-8.
What is the molecular formula of BIM-0042040.P001?
The molecular formula of BIM-0042040.P001 is C14H16N6O4.
What is the molecular weight of BIM-0042040.P001?
The molecular weight of BIM-0042040.P001 is 332.12 g/mol.
Where can I buy BIM-0042040.P001?
You can request a quote for BIM-0042040.P001 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BIM-0042040.P001?
Yes, KEHONG BIO provides custom synthesis services for BIM-0042040.P001 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.