TL;DR: 12-oxo-N-(o-tolyl)-1,2,3,4,9,9a-hexahydro-4a,9-(epiminoethano)xanthene-11-carboxamide (CAS 1008936-14-8) is a chemical compound with molecular formula C23H24N2O3 and molecular weight 376.17868 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-(2-methylphenyl)-16-oxo-2-oxa-15-azatetracyclo[7.5.3.01,10.03,8]heptadeca-3,5,7-triene-17-carboxamide
Also Known As: 12-oxo-N-(o-tolyl)-1,2,3,4,9,9a-hexahydro-4a,9-(epiminoethano)xanthene-11-carboxamide, F1351-0004, N-(2-methylphenyl)-16-oxo-2-oxa-15-azatetracyclo[7.5.3.0^{1,10}.0^{3,8}]heptadeca-3,5,7-triene-17-carboxamide, N-(2-methylphenyl)-16-oxo-2-oxa-15-azatetracyclo[7.5.3.01,10.03,8]heptadeca-3,5,7-triene-17-carboxamide, N-(2-methylphenyl)-12-oxo-1,2,3,4,9,9a-hexahydro-4a,9-(epiminoethano)xanthene-11-carboxamide
| Molecular Formula | C23H24N2O3 |
| Molecular Weight | 376.17868 g/mol |
| XLogP | 3.8 |
| Topological Polar Surface Area (TPSA) | 67.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 376.17868 Da |
| Heavy Atoms | 28 |
| Complexity | 637.0 |
| SMILES | CC1=CC=CC=C1NC(=O)C2C3C4CCCCC4(NC2=O)OC5=CC=CC=C35 |
| InChIKey | SJGLYUNTUZHSCL-UHFFFAOYSA-N |
The XLogP value of 3.8 indicates that 12-oxo-N-(o-tolyl)-1,2,3,4,9,9a-hexahydro-4a,9-(epiminoethano)xanthene-11-carboxamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 67.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 12-oxo-N-(o-tolyl)-1,2,3,4,9,9a-hexahydro-4a,9-(epiminoethano)xanthene-11-carboxamide. Following Lipinski's Rule of Five, 12-oxo-N-(o-tolyl)-1,2,3,4,9,9a-hexahydro-4a,9-(epiminoethano)xanthene-11-carboxamide has 2 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 12-oxo-N-(o-tolyl)-1,2,3,4,9,9a-hexahydro-4a,9-(epiminoethano)xanthene-11-carboxamide is 1008936-14-8.
The molecular formula of 12-oxo-N-(o-tolyl)-1,2,3,4,9,9a-hexahydro-4a,9-(epiminoethano)xanthene-11-carboxamide is C23H24N2O3.
The molecular weight of 12-oxo-N-(o-tolyl)-1,2,3,4,9,9a-hexahydro-4a,9-(epiminoethano)xanthene-11-carboxamide is 376.17868 g/mol.
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