TL;DR: 6H-Pyrido(4,3-b)carbazol-1-amine, 5,11-dimethyl-9-methoxy-N-(3-methylbutyl)-, (Z)-2-butenedioate (1:1) (CAS 115464-68-1) is a chemical compound with molecular formula C27H31N3O5 and molecular weight 477.22638 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
but-2-enedioic acid;9-methoxy-5,11-dimethyl-N-(3-methylbutyl)-6H-pyrido[4,3-b]carbazol-1-amine
Also Known As: 6H-Pyrido(4,3-b)carbazol-1-amine, 5,11-dimethyl-9-methoxy-N-(3-methylbutyl)-, (Z)-2-butenedioate (1:1), 5,11-Dimethyl-9-methoxy-N-(3-methylbutyl)-6H-pyrido(4,3-b)carbazol-1-amine maleate
| Molecular Formula | C27H31N3O5 |
| Molecular Weight | 477.22638 g/mol |
| XLogP | 5.66454 |
| Topological Polar Surface Area (TPSA) | 125.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 7 |
| Exact Mass | 477.22638 Da |
| Heavy Atoms | 35 |
| Complexity | 617.0 |
| SMILES | CC1=C2C=CN=C(C2=C(C3=C1NC4=C3C=C(C=C4)OC)C)NCCC(C)C.C(=CC(=O)O)C(=O)O |
| InChIKey | INTOLKOBAKUXEG-UHFFFAOYSA-N |
The XLogP value of 5.66454 indicates that 6H-Pyrido(4,3-b)carbazol-1-amine, 5,11-dimethyl-9-methoxy-N-(3-methylbutyl)-, (Z)-2-butenedioate (1:1) is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 125.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 6H-Pyrido(4,3-b)carbazol-1-amine, 5,11-dimethyl-9-methoxy-N-(3-methylbutyl)-, (Z)-2-butenedioate (1:1). Following Lipinski's Rule of Five, 6H-Pyrido(4,3-b)carbazol-1-amine, 5,11-dimethyl-9-methoxy-N-(3-methylbutyl)-, (Z)-2-butenedioate (1:1) has 4 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of 6H-Pyrido(4,3-b)carbazol-1-amine, 5,11-dimethyl-9-methoxy-N-(3-methylbutyl)-, (Z)-2-butenedioate (1:1) is 115464-68-1.
The molecular formula of 6H-Pyrido(4,3-b)carbazol-1-amine, 5,11-dimethyl-9-methoxy-N-(3-methylbutyl)-, (Z)-2-butenedioate (1:1) is C27H31N3O5.
The molecular weight of 6H-Pyrido(4,3-b)carbazol-1-amine, 5,11-dimethyl-9-methoxy-N-(3-methylbutyl)-, (Z)-2-butenedioate (1:1) is 477.22638 g/mol.
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