TL;DR: E201-0122 (CAS 864853-86-1) is a chemical compound with molecular formula C22H22N4O2 and molecular weight 374.1743 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-(4-butylphenyl)-6-methyl-2-oxo-1,6,8-triazatricyclo[7.4.0.03,7]trideca-3(7),4,8,10,12-pentaene-5-carboxamide
Also Known As: E201-0122, N-(4-butylphenyl)-1-methyl-4-oxo-1,4-dihydropyrido[1,2-a]pyrrolo[2,3-d]pyrimidine-2-carboxamide, F0697-0122, N-(4-butylphenyl)-6-methyl-2-oxo-1,6,8-triazatricyclo[7.4.0.0^{3,7}]trideca-3(7),4,8,10,12-pentaene-5-carboxamide, N-(4-butylphenyl)-6-methyl-2-oxo-1,6,8-triazatricyclo[7.4.0.03,7]trideca-3(7),4,8,10,12-pentaene-5-carboxamide
| Molecular Formula | C22H22N4O2 |
| Molecular Weight | 374.1743 g/mol |
| XLogP | 3.7 |
| Topological Polar Surface Area (TPSA) | 66.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 374.1743 Da |
| Heavy Atoms | 28 |
| Complexity | 705.0 |
| SMILES | CCCCC1=CC=C(C=C1)NC(=O)C2=CC3=C(N2C)N=C4C=CC=CN4C3=O |
| InChIKey | SJBDAFFIZDNECX-UHFFFAOYSA-N |
The XLogP value of 3.7 indicates that E201-0122 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 66.7 Ų falls within the moderate polarity range, balancing permeability and solubility for E201-0122. Following Lipinski's Rule of Five, E201-0122 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 E201-0122 is 864853-86-1.
The molecular formula of E201-0122 is C22H22N4O2.
The molecular weight of E201-0122 is 374.1743 g/mol.
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