TL;DR: C26H26N2O3 (CAS 1212451-36-9) is a chemical compound with molecular formula C26H26N2O3 and molecular weight 414.19434 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(1S,11S,12R,16S)-11-(2,2-dimethylpropanoyl)-14-(4-methylphenyl)-10,14-diazatetracyclo[8.6.0.02,7.012,16]hexadeca-2,4,6,8-tetraene-13,15-dione
Also Known As: (8S,8aR,11aS,11bS)-8-(2,2-dimethylpropanoyl)-10-(4-methylphenyl)-11a,11b-dihydro-8H-pyrrolo[3',4':3,4]pyrrolo[2,1-a]isoquinoline-9,11(8aH,10H)-dione, (8S,8aR,11aS,11bS)-8-pivaloyl-10-(p-tolyl)-11a,11b-dihydro-8H-pyrrolo[3',4':3,4]pyrrolo[2,1-a]isoquinoline-9,11(8aH,10H)-dione
| Molecular Formula | C26H26N2O3 |
| Molecular Weight | 414.19434 g/mol |
| XLogP | 4.0 |
| Topological Polar Surface Area (TPSA) | 57.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 414.19434 Da |
| Heavy Atoms | 31 |
| Complexity | 804.0 |
| SMILES | CC1=CC=C(C=C1)N2C(=O)[C@H]3[C@@H](C2=O)[C@H](N4[C@@H]3C5=CC=CC=C5C=C4)C(=O)C(C)(C)C |
| InChIKey | RJQCMQHPALJENL-CBPXPLCBSA-N |
The XLogP value of 4.0 indicates that C26H26N2O3 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 57.7 Ų, C26H26N2O3 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, C26H26N2O3 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 C26H26N2O3 is 1212451-36-9.
The molecular formula of C26H26N2O3 is C26H26N2O3.
The molecular weight of C26H26N2O3 is 414.19434 g/mol.
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