N-[4-(1,1-dioxo-1lambda~6~,2-thiazinan-2-yl)phenyl]-2-[4-(1H-pyrrol-1-yl)oxan-4-yl]acetamide
Chemical Structure Depiction of
N-[4-(1,1-dioxo-1lambda~6~,2-thiazinan-2-yl)phenyl]-2-[4-(1H-pyrrol-1-yl)oxan-4-yl]acetamide
N-[4-(1,1-dioxo-1lambda~6~,2-thiazinan-2-yl)phenyl]-2-[4-(1H-pyrrol-1-yl)oxan-4-yl]acetamide
Compound characteristics
| Compound ID: | Y042-7290 |
| Compound Name: | N-[4-(1,1-dioxo-1lambda~6~,2-thiazinan-2-yl)phenyl]-2-[4-(1H-pyrrol-1-yl)oxan-4-yl]acetamide |
| Molecular Weight: | 417.53 |
| Molecular Formula: | C21 H27 N3 O4 S |
| Smiles: | C1CCS(N(C1)c1ccc(cc1)NC(CC1(CCOCC1)n1cccc1)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.0422 |
| logD: | 2.0422 |
| logSw: | -2.7263 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 66.461 |
| InChI Key: | LBSWMNJKKIPTAE-UHFFFAOYSA-N |