TL;DR: N'-(3-carbamoyl-5,5-dimethyl-4,7-dihydrothieno[2,3-c]pyran-2-yl)-N-[2-(2-hydroxyethoxy)ethyl]oxamide (CAS 903869-28-3) is a chemical compound with molecular formula C16H23N3O6S and molecular weight 385.13077 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N'-(3-carbamoyl-5,5-dimethyl-4,7-dihydrothieno[2,3-c]pyran-2-yl)-N-[2-(2-hydroxyethoxy)ethyl]oxamide
Also Known As: N'-(3-carbamoyl-5,5-dimethyl-4,7-dihydrothieno[2,3-c]pyran-2-yl)-N-[2-(2-hydroxyethoxy)ethyl]oxamide, N-(3-carbamoyl-5,5-dimethyl-4,7-dihydro-5H-thieno[2,3-c]pyran-2-yl)-N'-[2-(2-hydroxyethoxy)ethyl]ethanediamide, N1-(3-carbamoyl-5,5-dimethyl-5,7-dihydro-4H-thieno[2,3-c]pyran-2-yl)-N2-(2-(2-hydroxyethoxy)ethyl)oxalamide
| Molecular Formula | C16H23N3O6S |
| Molecular Weight | 385.13077 g/mol |
| XLogP | -0.2 |
| Topological Polar Surface Area (TPSA) | 168.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 7 |
| Exact Mass | 385.13077 Da |
| Heavy Atoms | 26 |
| Complexity | 544.0 |
| SMILES | CC1(CC2=C(CO1)SC(=C2C(=O)N)NC(=O)C(=O)NCCOCCO)C |
| InChIKey | ZJSXCLYDYLABHN-UHFFFAOYSA-N |
The XLogP value of -0.2 indicates that N'-(3-carbamoyl-5,5-dimethyl-4,7-dihydrothieno[2,3-c]pyran-2-yl)-N-[2-(2-hydroxyethoxy)ethyl]oxamide is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 168.0 Ų indicates high polarity, suggesting N'-(3-carbamoyl-5,5-dimethyl-4,7-dihydrothieno[2,3-c]pyran-2-yl)-N-[2-(2-hydroxyethoxy)ethyl]oxamide may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, N'-(3-carbamoyl-5,5-dimethyl-4,7-dihydrothieno[2,3-c]pyran-2-yl)-N-[2-(2-hydroxyethoxy)ethyl]oxamide has 4 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of N'-(3-carbamoyl-5,5-dimethyl-4,7-dihydrothieno[2,3-c]pyran-2-yl)-N-[2-(2-hydroxyethoxy)ethyl]oxamide is 903869-28-3.
The molecular formula of N'-(3-carbamoyl-5,5-dimethyl-4,7-dihydrothieno[2,3-c]pyran-2-yl)-N-[2-(2-hydroxyethoxy)ethyl]oxamide is C16H23N3O6S.
The molecular weight of N'-(3-carbamoyl-5,5-dimethyl-4,7-dihydrothieno[2,3-c]pyran-2-yl)-N-[2-(2-hydroxyethoxy)ethyl]oxamide is 385.13077 g/mol.
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