TL;DR: BIM-0044077.P001 (CAS 1164490-25-8) is a chemical compound with molecular formula C15H16N4O and molecular weight 268.13242 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(2E)-2-cyano-2-(3,4-dihydro-1H-quinolin-2-ylidene)-N-(dimethylaminomethylidene)acetamide
Also Known As: BIM-0044077.P001, AH-262/33700022, (2E)-2-cyano-2-(3,4-dihydro-1H-quinolin-2-ylidene)-N-(dimethylaminomethylidene)acetamide, 2-cyano-2-(3,4-dihydro-2(1H)-quinolinylidene)-N-[(dimethylamino)methylene]acetamide, (2E,NE)-2-cyano-2-(3,4-dihydroquinolin-2(1H)-ylidene)-N-((dimethylamino)methylene)acetamide
| Molecular Formula | C15H16N4O |
| Molecular Weight | 268.13242 g/mol |
| XLogP | 1.8 |
| Topological Polar Surface Area (TPSA) | 68.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 268.13242 Da |
| Heavy Atoms | 20 |
| Complexity | 483.0 |
| SMILES | CN(C)C=NC(=O)/C(=C/1\CCC2=CC=CC=C2N1)/C#N |
| InChIKey | MZZQUNCFOIWVPC-IJBQXDECSA-N |
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BIM-0044077.P001. The TPSA of 68.5 Ų falls within the moderate polarity range, balancing permeability and solubility for BIM-0044077.P001. Following Lipinski's Rule of Five, BIM-0044077.P001 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 BIM-0044077.P001 is 1164490-25-8.
The molecular formula of BIM-0044077.P001 is C15H16N4O.
The molecular weight of BIM-0044077.P001 is 268.13242 g/mol.
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