1-(2-(2,2-Dimethyl(3-oxaindan-4-yloxy))acetyl)-4-methylthiosemicarbazide
TL;DR: 1-(2-(2,2-Dimethyl(3-oxaindan-4-yloxy))acetyl)-4-methylthiosemicarbazide (CAS 1023528-08-6) is a chemical compound with molecular formula C14H19N3O3S and molecular weight 309.11472 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-[[2-[(2,2-dimethyl-3H-1-benzofuran-7-yl)oxy]acetyl]amino]-3-methylthiourea
Also Known As: starbld0034356, 1-(2-(2,2-DIMETHYL(3-OXAINDAN-4-YLOXY))ACETYL)-4-METHYLTHIOSEMICARBAZIDE, 1-[[2-[(2,2-dimethyl-3H-1-benzofuran-7-yl)oxy]acetyl]amino]-3-methylthiourea, 2-[(2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl)oxy]-N-[(methylcarbamothioyl)amino]acetamide, 1-[[2-[(2,2-dimethyl-3H-benzofuran-7-yl)oxy]acetyl]amino]-3-methyl-thiourea
Technical Specifications
| Molecular Formula | C14H19N3O3S |
| Molecular Weight | 309.11472 g/mol |
| XLogP | 1.8 |
| Topological Polar Surface Area (TPSA) | 104.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 309.11472 Da |
| Heavy Atoms | 21 |
| Complexity | 403.0 |
| SMILES | CC1(CC2=C(O1)C(=CC=C2)OCC(=O)NNC(=S)NC)C |
| InChIKey | GTJVJGOGUPMVFY-UHFFFAOYSA-N |
Chemical Property Profile of 1-(2-(2,2-Dimethyl(3-oxaindan-4-yloxy))acetyl)-4-methylthiosemicarbazide
Property Insights of 1-(2-(2,2-Dimethyl(3-oxaindan-4-yloxy))acetyl)-4-methylthiosemicarbazide
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(2-(2,2-Dimethyl(3-oxaindan-4-yloxy))acetyl)-4-methylthiosemicarbazide. The TPSA of 104.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(2-(2,2-Dimethyl(3-oxaindan-4-yloxy))acetyl)-4-methylthiosemicarbazide. Following Lipinski's Rule of Five, 1-(2-(2,2-Dimethyl(3-oxaindan-4-yloxy))acetyl)-4-methylthiosemicarbazide has 3 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 1-(2-(2,2-Dimethyl(3-oxaindan-4-yloxy))acetyl)-4-methylthiosemicarbazide?
The CAS number of 1-(2-(2,2-Dimethyl(3-oxaindan-4-yloxy))acetyl)-4-methylthiosemicarbazide is 1023528-08-6.
What is the molecular formula of 1-(2-(2,2-Dimethyl(3-oxaindan-4-yloxy))acetyl)-4-methylthiosemicarbazide?
The molecular formula of 1-(2-(2,2-Dimethyl(3-oxaindan-4-yloxy))acetyl)-4-methylthiosemicarbazide is C14H19N3O3S.
What is the molecular weight of 1-(2-(2,2-Dimethyl(3-oxaindan-4-yloxy))acetyl)-4-methylthiosemicarbazide?
The molecular weight of 1-(2-(2,2-Dimethyl(3-oxaindan-4-yloxy))acetyl)-4-methylthiosemicarbazide is 309.11472 g/mol.
Where can I buy 1-(2-(2,2-Dimethyl(3-oxaindan-4-yloxy))acetyl)-4-methylthiosemicarbazide?
You can request a quote for 1-(2-(2,2-Dimethyl(3-oxaindan-4-yloxy))acetyl)-4-methylthiosemicarbazide directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1-(2-(2,2-Dimethyl(3-oxaindan-4-yloxy))acetyl)-4-methylthiosemicarbazide?
Yes, CoreyChem provides custom synthesis services for 1-(2-(2,2-Dimethyl(3-oxaindan-4-yloxy))acetyl)-4-methylthiosemicarbazide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.