TL;DR: Ergoline-8-carboxamide, N-butyl-6-methyl-, (8-beta)- (CAS 50504-27-3) is a chemical compound with molecular formula C20H27N3O and molecular weight 325.21542 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-butyl-7-methyl-6,6a,8,9,10,10a-hexahydro-4H-indolo[4,3-fg]quinoline-9-carboxamide
Also Known As: n-butyl-6-methylergoline-8-carboxamide, (8-beta)-N-Butyl-6-methylergoline-8-carboxamide, Ergoline-8-carboxamide, N-butyl-6-methyl-, (8-beta)-, N-Butyl-6-methylergoline-8-carboximidic acid, BRN 0764407
| Molecular Formula | C20H27N3O |
| Molecular Weight | 325.21542 g/mol |
| XLogP | 2.9 |
| Topological Polar Surface Area (TPSA) | 48.1 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 325.21542 Da |
| Heavy Atoms | 24 |
| Complexity | 468.0 |
| SMILES | CCCCNC(=O)C1CC2C(CC3=CNC4=CC=CC2=C34)N(C1)C |
| InChIKey | YWYWNPNJIAXPHW-UHFFFAOYSA-N |
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ergoline-8-carboxamide, N-butyl-6-methyl-, (8-beta)-. With a topological polar surface area (TPSA) of 48.1 Ų, Ergoline-8-carboxamide, N-butyl-6-methyl-, (8-beta)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ergoline-8-carboxamide, N-butyl-6-methyl-, (8-beta)- has 2 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of Ergoline-8-carboxamide, N-butyl-6-methyl-, (8-beta)- is 50504-27-3.
The molecular formula of Ergoline-8-carboxamide, N-butyl-6-methyl-, (8-beta)- is C20H27N3O.
The molecular weight of Ergoline-8-carboxamide, N-butyl-6-methyl-, (8-beta)- is 325.21542 g/mol.
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