TL;DR: RefChem:322185 (CAS 72593-21-6) is a chemical compound with molecular formula C23H26N4O and molecular weight 374.21066 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-[2-(3,6,17-triazatetracyclo[8.7.0.03,8.011,16]heptadeca-1(10),11,13,15-tetraen-6-yl)ethyl]benzamide
Also Known As: J1.610.025K, N-(2-(3,4,6,7,12,12a-Hexahydropyrazino(1',2':1,6)pyrido(3,4-b)indol-2(1H)-yl)ethyl)benzamide, Benzamide, N-(2-(3,4,6,7,12,12a-hexahydropyrazino(1',2':1,6)pyrido(3,4-b)indol-2(1H)-yl)ethyl)-, N-(2-{3,6,17-triazatetracyclo[8.7.0.03,8.011,16]heptadeca-1(10),11,13,15-tetraen-6-yl}ethyl)benzamide, N-[2-(1,2,3,4,6,7,12,12a-Octahydropyrazino[1 ,2 :1,6]pyrido[3,4-b]indole-2-yl)ethyl]benzamide
| Molecular Formula | C23H26N4O |
| Molecular Weight | 374.21066 g/mol |
| XLogP | 2.0 |
| Topological Polar Surface Area (TPSA) | 51.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 374.21066 Da |
| Heavy Atoms | 28 |
| Complexity | 549.0 |
| SMILES | C1CN2CC3=C(CC2CN1CCNC(=O)C4=CC=CC=C4)C5=CC=CC=C5N3 |
| InChIKey | GAUKOIAUVRRGOI-UHFFFAOYSA-N |
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:322185. With a topological polar surface area (TPSA) of 51.4 Ų, RefChem:322185 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:322185 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 RefChem:322185 is 72593-21-6.
The molecular formula of RefChem:322185 is C23H26N4O.
The molecular weight of RefChem:322185 is 374.21066 g/mol.
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