TL;DR: 2-Tosyl-2,3,3a,4-tetrahydrocyclopenta[c]pyrrol-5(1H)-one (CAS 133886-43-8) is a chemical compound with molecular formula C14H15NO3S and molecular weight 277.07727 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-(4-methylphenyl)sulfonyl-1,3,6,6a-tetrahydrocyclopenta[c]pyrrol-5-one
Also Known As: 2-Tosyl-2,3,3a,4-tetrahydrocyclopenta[c]pyrrol-5(1H)-one, 6136AA, 1,5-(Tosyliminobismethylene)cyclopentene-3-one, 3-Tosyl-3-azabicyclo[3.3.0]octa-5-ene-7-one, 7-Tosyl-7-azabicyclo[3.3.0]octa-1-ene-3-one
| Molecular Formula | C14H15NO3S |
| Molecular Weight | 277.07727 g/mol |
| XLogP | 0.7 |
| Topological Polar Surface Area (TPSA) | 62.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 277.07727 Da |
| Heavy Atoms | 19 |
| Complexity | 509.0 |
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)N2CC3CC(=O)C=C3C2 |
| InChIKey | ZBHRQYUKMBPPAE-UHFFFAOYSA-N |
The XLogP value of 0.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Tosyl-2,3,3a,4-tetrahydrocyclopenta[c]pyrrol-5(1H)-one. The TPSA of 62.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Tosyl-2,3,3a,4-tetrahydrocyclopenta[c]pyrrol-5(1H)-one. Following Lipinski's Rule of Five, 2-Tosyl-2,3,3a,4-tetrahydrocyclopenta[c]pyrrol-5(1H)-one has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 2-Tosyl-2,3,3a,4-tetrahydrocyclopenta[c]pyrrol-5(1H)-one is 133886-43-8.
The molecular formula of 2-Tosyl-2,3,3a,4-tetrahydrocyclopenta[c]pyrrol-5(1H)-one is C14H15NO3S.
The molecular weight of 2-Tosyl-2,3,3a,4-tetrahydrocyclopenta[c]pyrrol-5(1H)-one is 277.07727 g/mol.
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