BAS 00885969
TL;DR: BAS 00885969 (CAS 330843-10-2) is a chemical compound with molecular formula C24H18N2O6 and molecular weight 430.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[5-[(Z)-[1-(3,5-dimethylphenyl)-2,4,6-trioxo-1,3-diazinan-5-ylidene]methyl]furan-2-yl]benzoic acid
Also Known As: BAS 00885969, 4-(5-{(Z)-[1-(3,5-dimethylphenyl)-2,4,6-trioxotetrahydropyrimidin-5(2H)-ylidene]methyl}furan-2-yl)benzoic acid, (Z)-4-(5-((1-(3,5-dimethylphenyl)-2,4,6-trioxotetrahydropyrimidin-5(2H)-ylidene)methyl)furan-2-yl)benzoic acid, 4-(5-{(Z)-[1-(3,5-dimethylphenyl)-4-hydroxy-2,6-dioxo-1,6-dihydropyrimidin-5(2H)-ylidene]methyl}furan-2-yl)benzoic acid, 4-[5-[(Z)-[1-(3,5-dimethylphenyl)-2,4,6-trioxo-1,3-diazinan-5-ylidene]methyl]furan-2-yl]benzoic acid
| Molecular Formula | C24H18N2O6 |
|---|---|
| Molecular Weight | 430.12 g/mol |
| LogP | 3.92804 |
| Topological Polar Surface Area | 116.92 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 430.1165 |
| Heavy Atoms | 32 |
| Complexity | 1280.0286 |
Chemical Identifiers
| CAS Number | 330843-10-2 |
|---|---|
| SMILES | CC1=CC(=CC(=C1)N2C(=O)/C(=C\C3=CC=C(O3)C4=CC=C(C=C4)C(=O)O)/C(=O)NC2=O)C |
Product Overview
BAS 00885969 (CAS 330843-10-2), with molecular formula C24H18N2O6 and molecular weight 430.12 g/mol. IUPAC: 4-[5-[(Z)-[1-(3,5-dimethylphenyl)-2,4,6-trioxo-1,3-diazinan-5-ylidene]methyl]furan-2-yl]benzoic acid.
Chemical Property Profile of BAS 00885969
Property Insights of BAS 00885969
The XLogP value of 3.92804 indicates that BAS 00885969 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 116.92 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 00885969. Following Lipinski's Rule of Five, BAS 00885969 has 2 hydrogen bond donor(s) and 5 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 00885969?
The CAS number of BAS 00885969 is 330843-10-2.
What is the molecular formula of BAS 00885969?
The molecular formula of BAS 00885969 is C24H18N2O6.
What is the molecular weight of BAS 00885969?
The molecular weight of BAS 00885969 is 430.12 g/mol.
Where can I buy BAS 00885969?
You can request a quote for BAS 00885969 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00885969?
Yes, KEHONG BIO provides custom synthesis services for BAS 00885969 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.