TL;DR: Bmy 14802 (CAS 105565-56-8) is a chemical compound with molecular formula C18H22F2N4O and molecular weight 348.17618 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-(4-fluorophenyl)-4-[4-(5-fluoropyrimidin-2-yl)piperazin-1-yl]butan-1-ol
Also Known As: Bmy 14802, bmy-14802 hydrochloride, GTPL8, Bms 181100, BMY-14802, Skybridge
Top 5 of 2 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C18H22F2N4O |
| Molecular Weight | 348.17618 g/mol |
| XLogP | 2.2 |
| Topological Polar Surface Area (TPSA) | 52.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 348.17618 Da |
| Heavy Atoms | 25 |
| Complexity | 379.0 |
| SMILES | C1CN(CCN1CCCC(C2=CC=C(C=C2)F)O)C3=NC=C(C=N3)F |
| InChIKey | ZXUYYZPJUGQHLQ-UHFFFAOYSA-N |
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Bmy 14802. With a topological polar surface area (TPSA) of 52.5 Ų, Bmy 14802 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Bmy 14802 has 1 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of Bmy 14802 is 105565-56-8.
The molecular formula of Bmy 14802 is C18H22F2N4O.
The molecular weight of Bmy 14802 is 348.17618 g/mol.
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