TL;DR: (3-(1,1-dioxido-1,2-thiazinan-2-yl)phenyl)(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)methanone (CAS 1011880-21-9) is a chemical compound with molecular formula C18H24N2O5S and molecular weight 380.1406 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1,4-dioxa-8-azaspiro[4.5]decan-8-yl-[3-(1,1-dioxothiazinan-2-yl)phenyl]methanone
Also Known As: (3-(1,1-dioxido-1,2-thiazinan-2-yl)phenyl)(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)methanone, 1,4-dioxa-8-azaspiro[4.5]dec-8-yl[3-(1,1-dioxido-1,2-thiazinan-2-yl)phenyl]methanone, 1,4-dioxa-8-azaspiro[4.5]decan-8-yl-[3-(1,1-dioxothiazinan-2-yl)phenyl]methanone
| Molecular Formula | C18H24N2O5S |
| Molecular Weight | 380.1406 g/mol |
| XLogP | 1.0 |
| Topological Polar Surface Area (TPSA) | 84.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 380.1406 Da |
| Heavy Atoms | 26 |
| Complexity | 616.0 |
| SMILES | C1CCS(=O)(=O)N(C1)C2=CC=CC(=C2)C(=O)N3CCC4(CC3)OCCO4 |
| InChIKey | LMHVRWKQLJERHJ-UHFFFAOYSA-N |
The XLogP value of 1.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (3-(1,1-dioxido-1,2-thiazinan-2-yl)phenyl)(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)methanone. The TPSA of 84.5 Ų falls within the moderate polarity range, balancing permeability and solubility for (3-(1,1-dioxido-1,2-thiazinan-2-yl)phenyl)(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)methanone. Following Lipinski's Rule of Five, (3-(1,1-dioxido-1,2-thiazinan-2-yl)phenyl)(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)methanone has 0 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of (3-(1,1-dioxido-1,2-thiazinan-2-yl)phenyl)(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)methanone is 1011880-21-9.
The molecular formula of (3-(1,1-dioxido-1,2-thiazinan-2-yl)phenyl)(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)methanone is C18H24N2O5S.
The molecular weight of (3-(1,1-dioxido-1,2-thiazinan-2-yl)phenyl)(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)methanone is 380.1406 g/mol.
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