TL;DR: A-770041 (CAS 1140478-96-1) is a chemical compound with molecular formula C34H39N9O3 and molecular weight 621.31757 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-[4-[1-[4-(4-acetylpiperazin-1-yl)cyclohexyl]-4-aminopyrazolo[3,4-d]pyrimidin-3-yl]-2-methoxyphenyl]-1-methylindole-2-carboxamide
Also Known As: A-770041, 2c0o, KIN001-111, 3413AH, A 770041
| Molecular Formula | C34H39N9O3 |
| Molecular Weight | 621.31757 g/mol |
| XLogP | 3.3 |
| Topological Polar Surface Area (TPSA) | 136.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 6 |
| Exact Mass | 621.31757 Da |
| Heavy Atoms | 46 |
| Complexity | 1070.0 |
| SMILES | CC(=O)N1CCN(CC1)C2CCC(CC2)N3C4=NC=NC(=C4C(=N3)C5=CC(=C(C=C5)NC(=O)C6=CC7=CC=CC=C7N6C)OC)N |
| InChIKey | ZMNWFTYYYCSSTF-UHFFFAOYSA-N |
The XLogP value of 3.3 indicates that A-770041 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 136.0 Ų falls within the moderate polarity range, balancing permeability and solubility for A-770041. Following Lipinski's Rule of Five, A-770041 has 2 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of A-770041 is 1140478-96-1.
The molecular formula of A-770041 is C34H39N9O3.
The molecular weight of A-770041 is 621.31757 g/mol.
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