TL;DR: OPC 29030 (CAS 161190-38-1) is a chemical compound with molecular formula C22H23N3O3S and molecular weight 409.14603 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
6-[3-[(S)-[1-(2-methylphenyl)imidazol-2-yl]sulfinyl]propoxy]-3,4-dihydro-1H-quinolin-2-one
Also Known As: OPC 29030, (+)-OPC-29030, 6-(3-((S)-1-o-Tolyl-1H-imidazole-2-sulfinyl)-propoxy)-3,4-dihydro-1H-quinolin-2-one, 2(1H)-Quinolinone, 3,4-dihydro-6-(3-((1-(2-methylphenyl)-1H-imidazol-2-yl)sulfinyl)propoxy)-, (S)-, 2(1H)-Quinolinone, 3,4-dihydro-6-(3-((S)-(1-(2-methylphenyl)-1H-imidazol-2-yl)sulfinyl)propoxy)-
| Molecular Formula | C22H23N3O3S |
| Molecular Weight | 409.14603 g/mol |
| XLogP | 2.6 |
| Topological Polar Surface Area (TPSA) | 92.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 409.14603 Da |
| Heavy Atoms | 29 |
| Complexity | 590.0 |
| SMILES | CC1=CC=CC=C1N2C=CN=C2[S@@](=O)CCCOC3=CC4=C(C=C3)NC(=O)CC4 |
| InChIKey | NWEQSTQRGHLUQL-LJAQVGFWSA-N |
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for OPC 29030. The TPSA of 92.4 Ų falls within the moderate polarity range, balancing permeability and solubility for OPC 29030. Following Lipinski's Rule of Five, OPC 29030 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 OPC 29030 is 161190-38-1.
The molecular formula of OPC 29030 is C22H23N3O3S.
The molecular weight of OPC 29030 is 409.14603 g/mol.
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