TL;DR: C17H19ClN2O3 (CAS 1212188-33-4) is a chemical compound with molecular formula C17H19ClN2O3 and molecular weight 334.10843 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
ethyl (1S)-2-(2-chloroacetyl)-1-methyl-4,9-dihydro-3H-pyrido[3,4-b]indole-1-carboxylate
Also Known As: ethyl (1S)-2-(2-chloroacetyl)-1-methyl-4,9-dihydro-3H-pyrido[3,4-b]indole-1-carboxylate, ethyl (1S)-2-(chloroacetyl)-1-methyl-2,3,4,9-tetrahydro-1H-beta-carboline-1-carboxylate, (S)-ethyl 2-(2-chloroacetyl)-1-methyl-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole-1-carboxylate
| Molecular Formula | C17H19ClN2O3 |
| Molecular Weight | 334.10843 g/mol |
| XLogP | 2.7 |
| Topological Polar Surface Area (TPSA) | 62.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 334.10843 Da |
| Heavy Atoms | 23 |
| Complexity | 486.0 |
| SMILES | CCOC(=O)[C@@]1(C2=C(CCN1C(=O)CCl)C3=CC=CC=C3N2)C |
| InChIKey | GGWKIVZOKZBRKM-KRWDZBQOSA-N |
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for C17H19ClN2O3. The TPSA of 62.4 Ų falls within the moderate polarity range, balancing permeability and solubility for C17H19ClN2O3. Following Lipinski's Rule of Five, C17H19ClN2O3 has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of C17H19ClN2O3 is 1212188-33-4.
The molecular formula of C17H19ClN2O3 is C17H19ClN2O3.
The molecular weight of C17H19ClN2O3 is 334.10843 g/mol.
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