Dimethyl 4,4'-(methanediyldiimino)bis(1,2,5-oxadiazole-3-carboxylate)
TL;DR: Dimethyl 4,4'-(methanediyldiimino)bis(1,2,5-oxadiazole-3-carboxylate) (CAS 300800-18-4) is a chemical compound with molecular formula C9H10N6O6 and molecular weight 298.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 4-[[(4-methoxycarbonyl-1,2,5-oxadiazol-3-yl)amino]methylamino]-1,2,5-oxadiazole-3-carboxylate
Also Known As: dimethyl 4,4'-(methanediyldiimino)bis(1,2,5-oxadiazole-3-carboxylate), dimethyl 4,4'-(methylenebis(azanediyl))bis(1,2,5-oxadiazole-3-carboxylate), methyl 4-[({[4-(methoxycarbonyl)-1,2,5-oxadiazol-3-yl]amino}methyl)amino]-1,2, 5-oxadiazole-3-carboxylate, methyl 4-[[(4-methoxycarbonyl-1,2,5-oxadiazol-3-yl)amino]methylamino]-1,2,5-oxadiazole-3-carboxylate
| Molecular Formula | C9H10N6O6 |
|---|---|
| Molecular Weight | 298.07 g/mol |
| LogP | -0.4927 |
| Topological Polar Surface Area | 154.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 12 |
| Rotatable Bonds | 6 |
| Exact Mass | 298.0662 |
| Heavy Atoms | 21 |
| Complexity | 581.96655 |
Chemical Identifiers
| CAS Number | 300800-18-4 |
|---|---|
| SMILES | COC(=O)C1=NON=C1NCNC2=NON=C2C(=O)OC |
Product Overview
Dimethyl 4,4'-(methanediyldiimino)bis(1,2,5-oxadiazole-3-carboxylate) (CAS 300800-18-4), with molecular formula C9H10N6O6 and molecular weight 298.07 g/mol. IUPAC: methyl 4-[[(4-methoxycarbonyl-1,2,5-oxadiazol-3-yl)amino]methylamino]-1,2,5-oxadiazole-3-carboxylate.
Chemical Property Profile of Dimethyl 4,4'-(methanediyldiimino)bis(1,2,5-oxadiazole-3-carboxylate)
Property Insights of Dimethyl 4,4'-(methanediyldiimino)bis(1,2,5-oxadiazole-3-carboxylate)
The XLogP value of -0.4927 indicates that Dimethyl 4,4'-(methanediyldiimino)bis(1,2,5-oxadiazole-3-carboxylate) is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 154.5 Ų indicates high polarity, suggesting Dimethyl 4,4'-(methanediyldiimino)bis(1,2,5-oxadiazole-3-carboxylate) may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Dimethyl 4,4'-(methanediyldiimino)bis(1,2,5-oxadiazole-3-carboxylate) has 2 hydrogen bond donor(s) and 12 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Dimethyl 4,4'-(methanediyldiimino)bis(1,2,5-oxadiazole-3-carboxylate)?
The CAS number of Dimethyl 4,4'-(methanediyldiimino)bis(1,2,5-oxadiazole-3-carboxylate) is 300800-18-4.
What is the molecular formula of Dimethyl 4,4'-(methanediyldiimino)bis(1,2,5-oxadiazole-3-carboxylate)?
The molecular formula of Dimethyl 4,4'-(methanediyldiimino)bis(1,2,5-oxadiazole-3-carboxylate) is C9H10N6O6.
What is the molecular weight of Dimethyl 4,4'-(methanediyldiimino)bis(1,2,5-oxadiazole-3-carboxylate)?
The molecular weight of Dimethyl 4,4'-(methanediyldiimino)bis(1,2,5-oxadiazole-3-carboxylate) is 298.07 g/mol.
Where can I buy Dimethyl 4,4'-(methanediyldiimino)bis(1,2,5-oxadiazole-3-carboxylate)?
You can request a quote for Dimethyl 4,4'-(methanediyldiimino)bis(1,2,5-oxadiazole-3-carboxylate) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Dimethyl 4,4'-(methanediyldiimino)bis(1,2,5-oxadiazole-3-carboxylate)?
Yes, KEHONG BIO provides custom synthesis services for Dimethyl 4,4'-(methanediyldiimino)bis(1,2,5-oxadiazole-3-carboxylate) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.