TL;DR: CR 608 (CAS 57227-42-6) is a chemical compound with molecular formula C24H31N3O7 and molecular weight 473.2162 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-[3-[4-[2-(dimethylamino)ethoxy]phenyl]-1-(ethylamino)-1-oxopropan-2-yl]benzamide;oxalic acid
Also Known As: CR 608, O-(2-Dimethylaminoethyl)-N-benzoyl-DL-tyrosyl-ethylamide oxalate, (+-)-alpha-(Benzoylamino)-4-(2-(dimethylamino)ethoxy)-N-ethylhydrocinnamamide oxalate, Hydrocinnamamide, alpha-(benzoylamino)-4-(2-(dimethylamino)ethoxy)-N-ethyl-, oxalate, (+-)-, N-[2-[4-(2-DIMETHYLAMINOETHOXY)PHENYL]-1-(ETHYLCARBAMOYL)ETHYL]BENZAMIDE; OXALIC ACID
| Molecular Formula | C24H31N3O7 |
| Molecular Weight | 473.2162 g/mol |
| XLogP | 1.26 |
| Topological Polar Surface Area (TPSA) | 145.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 11 |
| Exact Mass | 473.2162 Da |
| Heavy Atoms | 34 |
| Complexity | 541.0 |
| SMILES | CCNC(=O)C(CC1=CC=C(C=C1)OCCN(C)C)NC(=O)C2=CC=CC=C2.C(=O)(C(=O)O)O |
| InChIKey | DQTDVCOQJFNTLG-UHFFFAOYSA-N |
The XLogP value of 1.26 suggests moderate lipophilicity, balancing water solubility and membrane permeability for CR 608. The TPSA of 145.0 Ų indicates high polarity, suggesting CR 608 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, CR 608 has 4 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of CR 608 is 57227-42-6.
The molecular formula of CR 608 is C24H31N3O7.
The molecular weight of CR 608 is 473.2162 g/mol.
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