![ethyl 7,7-dimethyl-2-(2-methylprop-2-enylcarbamothioylamino)-5,8-dihydropyrano[4,3-b]pyridine-3-carboxylate structure](/static/products/371/371931-89-4.png)
ethyl 7,7-dimethyl-2-(2-methylprop-2-enylcarbamothioylamino)-5,8-dihydropyrano[4,3-b]pyridine-3-carboxylate
TL;DR: ethyl 7,7-dimethyl-2-(2-methylprop-2-enylcarbamothioylamino)-5,8-dihydropyrano[4,3-b]pyridine-3-carboxylate (CAS 371931-89-4) is a chemical compound with molecular formula C18H25N3O3S and molecular weight 363.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 7,7-dimethyl-2-(2-methylprop-2-enylcarbamothioylamino)-5,8-dihydropyrano[4,3-b]pyridine-3-carboxylate
Also Known As: ethyl 7,7-dimethyl-2-(2-methylprop-2-enylcarbamothioylamino)-5,8-dihydropyrano[4,3-b]pyridine-3-carboxylate, ethyl 7,7-dimethyl-2-(3-(2-methylallyl)thioureido)-7,8-dihydro-5H-pyrano[4,3-b]pyridine-3-carboxylate, ethyl 7,7-dimethyl-2-{[(2-methylprop-2-en-1-yl)carbamothioyl]amino}-7,8-dihydro-5H-pyrano[4,3-b]pyridine-3-carboxylate
| Molecular Formula | C18H25N3O3S |
|---|---|
| Molecular Weight | 363.16 g/mol |
| LogP | 2.9721 |
| Topological Polar Surface Area | 72.48 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 363.16165 |
| Heavy Atoms | 25 |
| Complexity | 701.0519 |
Chemical Identifiers
| CAS Number | 371931-89-4 |
|---|---|
| SMILES | CCOC(=O)C1=C(N=C2CC(OCC2=C1)(C)C)NC(=S)NCC(=C)C |
Product Overview
ethyl 7,7-dimethyl-2-(2-methylprop-2-enylcarbamothioylamino)-5,8-dihydropyrano[4,3-b]pyridine-3-carboxylate (CAS 371931-89-4), with molecular formula C18H25N3O3S and molecular weight 363.16 g/mol. IUPAC: ethyl 7,7-dimethyl-2-(2-methylprop-2-enylcarbamothioylamino)-5,8-dihydropyrano[4,3-b]pyridine-3-carboxylate.
Chemical Property Profile of ethyl 7,7-dimethyl-2-(2-methylprop-2-enylcarbamothioylamino)-5,8-dihydropyrano[4,3-b]pyridine-3-carboxylate
Property Insights of ethyl 7,7-dimethyl-2-(2-methylprop-2-enylcarbamothioylamino)-5,8-dihydropyrano[4,3-b]pyridine-3-carboxylate
The XLogP value of 2.9721 suggests moderate lipophilicity, balancing water solubility and membrane permeability for ethyl 7,7-dimethyl-2-(2-methylprop-2-enylcarbamothioylamino)-5,8-dihydropyrano[4,3-b]pyridine-3-carboxylate. The TPSA of 72.48 Ų falls within the moderate polarity range, balancing permeability and solubility for ethyl 7,7-dimethyl-2-(2-methylprop-2-enylcarbamothioylamino)-5,8-dihydropyrano[4,3-b]pyridine-3-carboxylate. Following Lipinski's Rule of Five, ethyl 7,7-dimethyl-2-(2-methylprop-2-enylcarbamothioylamino)-5,8-dihydropyrano[4,3-b]pyridine-3-carboxylate 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 ethyl 7,7-dimethyl-2-(2-methylprop-2-enylcarbamothioylamino)-5,8-dihydropyrano[4,3-b]pyridine-3-carboxylate?
The CAS number of ethyl 7,7-dimethyl-2-(2-methylprop-2-enylcarbamothioylamino)-5,8-dihydropyrano[4,3-b]pyridine-3-carboxylate is 371931-89-4.
What is the molecular formula of ethyl 7,7-dimethyl-2-(2-methylprop-2-enylcarbamothioylamino)-5,8-dihydropyrano[4,3-b]pyridine-3-carboxylate?
The molecular formula of ethyl 7,7-dimethyl-2-(2-methylprop-2-enylcarbamothioylamino)-5,8-dihydropyrano[4,3-b]pyridine-3-carboxylate is C18H25N3O3S.
What is the molecular weight of ethyl 7,7-dimethyl-2-(2-methylprop-2-enylcarbamothioylamino)-5,8-dihydropyrano[4,3-b]pyridine-3-carboxylate?
The molecular weight of ethyl 7,7-dimethyl-2-(2-methylprop-2-enylcarbamothioylamino)-5,8-dihydropyrano[4,3-b]pyridine-3-carboxylate is 363.16 g/mol.
Where can I buy ethyl 7,7-dimethyl-2-(2-methylprop-2-enylcarbamothioylamino)-5,8-dihydropyrano[4,3-b]pyridine-3-carboxylate?
You can request a quote for ethyl 7,7-dimethyl-2-(2-methylprop-2-enylcarbamothioylamino)-5,8-dihydropyrano[4,3-b]pyridine-3-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ethyl 7,7-dimethyl-2-(2-methylprop-2-enylcarbamothioylamino)-5,8-dihydropyrano[4,3-b]pyridine-3-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for ethyl 7,7-dimethyl-2-(2-methylprop-2-enylcarbamothioylamino)-5,8-dihydropyrano[4,3-b]pyridine-3-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.