TL;DR: ASN 09877015 (CAS 1025364-70-8) is a chemical compound with molecular formula C22H25FN2O5S and molecular weight 448.14682 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-[1-(4-fluorophenyl)sulfonylpyrrolidin-2-yl]methanone
Also Known As: ASN 09877015, 2-{1-[(4-fluorophenyl)sulfonyl]prolyl}-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinoline, (6,7-Dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-[1-(4-fluoro-benzenesulfonyl)-pyrrolidin-2-yl]-methanone, (6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-[1-(4-fluorophenyl)sulfonylpyrrolidin-2-yl]methanone, (6,7-dimethoxy-3,4-dihydroisoquinolin-2(1H)-yl)(1-((4-fluorophenyl)sulfonyl)pyrrolidin-2-yl)methanone
| Molecular Formula | C22H25FN2O5S |
| Molecular Weight | 448.14682 g/mol |
| XLogP | 2.7 |
| Topological Polar Surface Area (TPSA) | 84.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 448.14682 Da |
| Heavy Atoms | 31 |
| Complexity | 737.0 |
| SMILES | COC1=C(C=C2CN(CCC2=C1)C(=O)C3CCCN3S(=O)(=O)C4=CC=C(C=C4)F)OC |
| InChIKey | VIDGKUXEHFUWDZ-UHFFFAOYSA-N |
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for ASN 09877015. The TPSA of 84.5 Ų falls within the moderate polarity range, balancing permeability and solubility for ASN 09877015. Following Lipinski's Rule of Five, ASN 09877015 has 0 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of ASN 09877015 is 1025364-70-8.
The molecular formula of ASN 09877015 is C22H25FN2O5S.
The molecular weight of ASN 09877015 is 448.14682 g/mol.
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