DBeQ
TL;DR: DBeQ (CAS 177355-84-9) is a chemical compound with molecular formula C20H24N2O8 and molecular weight 420.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
DBeQ
3-[5-[[3-(2-carboxyethyl)-4-(carboxymethyl)-5-methyl-2H-pyrrol-2-yl]methyl]-4-(carboxymethyl)-2H-pyrrol-3-yl]propanoic acid
Also Known As: DBeQ, dipyrromethane cofactor, 2,4-Quinazolinediamine, N2,N4-bis(phenylmethyl)-, 3-[5-[[3-(2-carboxyethyl)-4-(carboxymethyl)-5-methyl-2H-pyrrol-2-yl]methyl]-4-(carboxymethyl)-2H-pyrrol-3-yl]propanoic acid, 3-[5-{[3-(2-carboxyethyl)-4-(carboxymethyl)-5-methyl-2h-pyrrol-2-yl]methyl}-4-(carboxymethyl)-2h-pyrrol-3-yl]propanoic acid
| Molecular Formula | C20H24N2O8 |
|---|---|
| Molecular Weight | 420.15 g/mol |
| LogP | -2.3 |
| Topological Polar Surface Area | 174.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 12 |
| Exact Mass | 420.15326 |
| Heavy Atoms | 30 |
| Complexity | 894.0 |
Chemical Identifiers
| CAS Number | 177355-84-9 |
|---|---|
| SMILES | CC1=NC(C(=C1CC(=O)O)CCC(=O)O)CC2=NCC(=C2CC(=O)O)CCC(=O)O |
| InChIKey | PIVMSLFNTMAVDI-UHFFFAOYSA-N |
Product Overview
DBeQ (CAS 177355-84-9), with molecular formula C20H24N2O8 and molecular weight 420.15 g/mol. IUPAC: 3-[5-[[3-(2-carboxyethyl)-4-(carboxymethyl)-5-methyl-2H-pyrrol-2-yl]methyl]-4-(carboxymethyl)-2H-pyrrol-3-yl]propanoic acid.
Chemical Property Profile of DBeQ
Property Insights of DBeQ
The XLogP value of -2.3 indicates that DBeQ is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 174.0 Ų indicates high polarity, suggesting DBeQ may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, DBeQ has 4 hydrogen bond donor(s) and 10 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 DBeQ?
The CAS number of DBeQ is 177355-84-9.
What is the molecular formula of DBeQ?
The molecular formula of DBeQ is C20H24N2O8.
What is the molecular weight of DBeQ?
The molecular weight of DBeQ is 420.15 g/mol.
Where can I buy DBeQ?
You can request a quote for DBeQ directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for DBeQ?
Yes, KEHONG BIO provides custom synthesis services for DBeQ and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.