TL;DR: Bms 188107 (CAS 163629-03-6) is a chemical compound with molecular formula C25H26N2O4 and molecular weight 418.18927 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(3R,4S)-6-benzyl-3-hydroxy-2,2-dimethyl-4-(2-oxopyrrolidin-1-yl)-3,4-dihydropyrano[3,2-c]quinolin-5-one
Also Known As: Bms 188107, KST-1A1871, 5H-Pyrano(3,2-c)quinolin-5-one, 2,3,4,6-tetrahydro-3-hydroxy-2,2-dimethyl-4-(2-oxo-1-pyrrolidinyl)-6-(phenylmethyl)-, trans-, (3r,4s)-6-benzyl-3-hydroxy-2,2-dimethyl-4-(2-oxopyrrolidin-1-yl)-2,3,4,6-tetrahydro-5h-pyrano[3,2-c]quinolin-5-one, (3R,4S)-6-benzyl-3-hydroxy-2,2-dimethyl-4-(2-oxopyrrolidin-1-yl)-3,4-dihydropyrano[3,2-c]quinolin-5-one
Top 5 of 2 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C25H26N2O4 |
| Molecular Weight | 418.18927 g/mol |
| XLogP | 1.9 |
| Topological Polar Surface Area (TPSA) | 70.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 418.18927 Da |
| Heavy Atoms | 31 |
| Complexity | 769.0 |
| SMILES | CC1([C@@H]([C@H](C2=C(O1)C3=CC=CC=C3N(C2=O)CC4=CC=CC=C4)N5CCCC5=O)O)C |
| InChIKey | KLSKINYBELQIRV-JTHBVZDNSA-N |
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Bms 188107. The TPSA of 70.1 Ų falls within the moderate polarity range, balancing permeability and solubility for Bms 188107. Following Lipinski's Rule of Five, Bms 188107 has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of Bms 188107 is 163629-03-6.
The molecular formula of Bms 188107 is C25H26N2O4.
The molecular weight of Bms 188107 is 418.18927 g/mol.
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