TL;DR: 5-oxo-N-prop-2-enyl-3,9b-dihydro-2H-[1,3]thiazolo[2,3-a]isoindole-3-carboxamide (CAS 1008958-44-8) is a chemical compound with molecular formula C14H14N2O2S and molecular weight 274.0776 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
5-oxo-N-prop-2-enyl-3,9b-dihydro-2H-[1,3]thiazolo[2,3-a]isoindole-3-carboxamide
Also Known As: 5-oxo-N-prop-2-enyl-3,9b-dihydro-2H-[1,3]thiazolo[2,3-a]isoindole-3-carboxamide, (3S,9bR)-5-oxo-N-prop-2-enyl-3,9b-dihydro-2H-[1,3]thiazolo[2,3-a]isoindole-3-carboxamide
| Molecular Formula | C14H14N2O2S |
| Molecular Weight | 274.0776 g/mol |
| XLogP | 1.5 |
| Topological Polar Surface Area (TPSA) | 74.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 274.0776 Da |
| Heavy Atoms | 19 |
| Complexity | 412.0 |
| SMILES | C=CCNC(=O)C1CSC2N1C(=O)C3=CC=CC=C23 |
| InChIKey | KPJPUYPRFZEJEY-UHFFFAOYSA-N |
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-oxo-N-prop-2-enyl-3,9b-dihydro-2H-[1,3]thiazolo[2,3-a]isoindole-3-carboxamide. The TPSA of 74.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-oxo-N-prop-2-enyl-3,9b-dihydro-2H-[1,3]thiazolo[2,3-a]isoindole-3-carboxamide. Following Lipinski's Rule of Five, 5-oxo-N-prop-2-enyl-3,9b-dihydro-2H-[1,3]thiazolo[2,3-a]isoindole-3-carboxamide has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 5-oxo-N-prop-2-enyl-3,9b-dihydro-2H-[1,3]thiazolo[2,3-a]isoindole-3-carboxamide is 1008958-44-8.
The molecular formula of 5-oxo-N-prop-2-enyl-3,9b-dihydro-2H-[1,3]thiazolo[2,3-a]isoindole-3-carboxamide is C14H14N2O2S.
The molecular weight of 5-oxo-N-prop-2-enyl-3,9b-dihydro-2H-[1,3]thiazolo[2,3-a]isoindole-3-carboxamide is 274.0776 g/mol.
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