TL;DR: (4-(2-ethylbenzofuro[3,2-d]pyrimidin-4-yl)piperazin-1-yl)(phenyl)methanone hydrochloride (CAS 1049741-64-1) is a chemical compound with molecular formula C23H23ClN4O2 and molecular weight 422.15094 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[4-(2-ethyl-[1]benzofuro[3,2-d]pyrimidin-4-yl)piperazin-1-yl]-phenylmethanone;hydrochloride
Also Known As: (4-(2-ethylbenzofuro[3,2-d]pyrimidin-4-yl)piperazin-1-yl)(phenyl)methanone hydrochloride, [4-(2-Ethyl-benzo[4,5]furo[3,2-d]pyrimidin-4-yl)-piperazin-1-yl]-phenyl-methanone
| Molecular Formula | C23H23ClN4O2 |
| Molecular Weight | 422.15094 g/mol |
| XLogP | 4.3226 |
| Topological Polar Surface Area (TPSA) | 62.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 422.15094 Da |
| Heavy Atoms | 30 |
| Complexity | 573.0 |
| SMILES | CCC1=NC2=C(C(=N1)N3CCN(CC3)C(=O)C4=CC=CC=C4)OC5=CC=CC=C52.Cl |
| InChIKey | ZDKJMFBXDFNSEW-UHFFFAOYSA-N |
The XLogP value of 4.3226 indicates that (4-(2-ethylbenzofuro[3,2-d]pyrimidin-4-yl)piperazin-1-yl)(phenyl)methanone hydrochloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 62.5 Ų falls within the moderate polarity range, balancing permeability and solubility for (4-(2-ethylbenzofuro[3,2-d]pyrimidin-4-yl)piperazin-1-yl)(phenyl)methanone hydrochloride. Following Lipinski's Rule of Five, (4-(2-ethylbenzofuro[3,2-d]pyrimidin-4-yl)piperazin-1-yl)(phenyl)methanone hydrochloride has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of (4-(2-ethylbenzofuro[3,2-d]pyrimidin-4-yl)piperazin-1-yl)(phenyl)methanone hydrochloride is 1049741-64-1.
The molecular formula of (4-(2-ethylbenzofuro[3,2-d]pyrimidin-4-yl)piperazin-1-yl)(phenyl)methanone hydrochloride is C23H23ClN4O2.
The molecular weight of (4-(2-ethylbenzofuro[3,2-d]pyrimidin-4-yl)piperazin-1-yl)(phenyl)methanone hydrochloride is 422.15094 g/mol.
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