TL;DR: 4-chloro-N-(8-methyl-8-azabicyclo[3.2.1]oct-2-en-3-yl)-N-phenylbenzamide (CAS 161808-00-0) is a chemical compound with molecular formula C21H21ClN2O and molecular weight 352.13425 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-chloro-N-(8-methyl-8-azabicyclo[3.2.1]oct-2-en-3-yl)-N-phenylbenzamide
Also Known As: BAS 01059645, IDI1_021144, AH-262/31955030, BRD-A04975268-003-01-7, 4-chloro-N-(8-methyl-8-azabicyclo[3.2.1]oct-2-en-3-yl)-N-phenylbenzamide
| Molecular Formula | C21H21ClN2O |
| Molecular Weight | 352.13425 g/mol |
| XLogP | 4.5 |
| Topological Polar Surface Area (TPSA) | 23.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 352.13425 Da |
| Heavy Atoms | 25 |
| Complexity | 520.0 |
| SMILES | CN1C2CCC1C=C(C2)N(C3=CC=CC=C3)C(=O)C4=CC=C(C=C4)Cl |
| InChIKey | PAAJTXSXVPEGFW-UHFFFAOYSA-N |
The XLogP value of 4.5 indicates that 4-chloro-N-(8-methyl-8-azabicyclo[3.2.1]oct-2-en-3-yl)-N-phenylbenzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 23.6 Ų, 4-chloro-N-(8-methyl-8-azabicyclo[3.2.1]oct-2-en-3-yl)-N-phenylbenzamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-chloro-N-(8-methyl-8-azabicyclo[3.2.1]oct-2-en-3-yl)-N-phenylbenzamide has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 4-chloro-N-(8-methyl-8-azabicyclo[3.2.1]oct-2-en-3-yl)-N-phenylbenzamide is 161808-00-0.
The molecular formula of 4-chloro-N-(8-methyl-8-azabicyclo[3.2.1]oct-2-en-3-yl)-N-phenylbenzamide is C21H21ClN2O.
The molecular weight of 4-chloro-N-(8-methyl-8-azabicyclo[3.2.1]oct-2-en-3-yl)-N-phenylbenzamide is 352.13425 g/mol.
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