[(1,3-Dioxaindan-5-yl)carbamoyl]methyl 3,6-dichloropyridine-2-carboxylate
TL;DR: [(1,3-Dioxaindan-5-yl)carbamoyl]methyl 3,6-dichloropyridine-2-carboxylate (CAS 756828-90-7) is a chemical compound with molecular formula C15H10Cl2N2O5 and molecular weight 368.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-(1,3-benzodioxol-5-ylamino)-2-oxoethyl] 3,6-dichloropyridine-2-carboxylate
Also Known As: [(1,3-dioxaindan-5-yl)carbamoyl]methyl 3,6-dichloropyridine-2-carboxylate|[2-(1,3-benzodioxol-5-ylamino)-2-oxoethyl] 3,6-dichloropyridine-2-carboxylate|MLS001017622|SMR000353835|EN300-26610770
| Molecular Formula | C15H10Cl2N2O5 |
|---|---|
| Molecular Weight | 368.00 g/mol |
| LogP | 2.9126 |
| Topological Polar Surface Area | 86.75 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 367.99667 |
| Heavy Atoms | 24 |
| Complexity | 812.4466 |
Chemical Identifiers
| CAS Number | 756828-90-7 |
|---|---|
| SMILES | C1OC2=C(O1)C=C(C=C2)NC(=O)COC(=O)C3=C(C=CC(=N3)Cl)Cl |
Product Overview
[(1,3-Dioxaindan-5-yl)carbamoyl]methyl 3,6-dichloropyridine-2-carboxylate (CAS 756828-90-7), with molecular formula C15H10Cl2N2O5 and molecular weight 368.00 g/mol. IUPAC: [2-(1,3-benzodioxol-5-ylamino)-2-oxoethyl] 3,6-dichloropyridine-2-carboxylate.
Chemical Property Profile of [(1,3-Dioxaindan-5-yl)carbamoyl]methyl 3,6-dichloropyridine-2-carboxylate
Property Insights of [(1,3-Dioxaindan-5-yl)carbamoyl]methyl 3,6-dichloropyridine-2-carboxylate
The XLogP value of 2.9126 suggests moderate lipophilicity, balancing water solubility and membrane permeability for [(1,3-Dioxaindan-5-yl)carbamoyl]methyl 3,6-dichloropyridine-2-carboxylate. The TPSA of 86.75 Ų falls within the moderate polarity range, balancing permeability and solubility for [(1,3-Dioxaindan-5-yl)carbamoyl]methyl 3,6-dichloropyridine-2-carboxylate. Following Lipinski's Rule of Five, [(1,3-Dioxaindan-5-yl)carbamoyl]methyl 3,6-dichloropyridine-2-carboxylate has 1 hydrogen bond donor(s) and 6 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 [(1,3-Dioxaindan-5-yl)carbamoyl]methyl 3,6-dichloropyridine-2-carboxylate?
The CAS number of [(1,3-Dioxaindan-5-yl)carbamoyl]methyl 3,6-dichloropyridine-2-carboxylate is 756828-90-7.
What is the molecular formula of [(1,3-Dioxaindan-5-yl)carbamoyl]methyl 3,6-dichloropyridine-2-carboxylate?
The molecular formula of [(1,3-Dioxaindan-5-yl)carbamoyl]methyl 3,6-dichloropyridine-2-carboxylate is C15H10Cl2N2O5.
What is the molecular weight of [(1,3-Dioxaindan-5-yl)carbamoyl]methyl 3,6-dichloropyridine-2-carboxylate?
The molecular weight of [(1,3-Dioxaindan-5-yl)carbamoyl]methyl 3,6-dichloropyridine-2-carboxylate is 368.00 g/mol.
Where can I buy [(1,3-Dioxaindan-5-yl)carbamoyl]methyl 3,6-dichloropyridine-2-carboxylate?
You can request a quote for [(1,3-Dioxaindan-5-yl)carbamoyl]methyl 3,6-dichloropyridine-2-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [(1,3-Dioxaindan-5-yl)carbamoyl]methyl 3,6-dichloropyridine-2-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for [(1,3-Dioxaindan-5-yl)carbamoyl]methyl 3,6-dichloropyridine-2-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.