methyl 4-[2-chloro-4-(1,1-dioxo-1lambda~6~,2-thiazinan-2-yl)benzamido]benzoate
Chemical Structure Depiction of
methyl 4-[2-chloro-4-(1,1-dioxo-1lambda~6~,2-thiazinan-2-yl)benzamido]benzoate
methyl 4-[2-chloro-4-(1,1-dioxo-1lambda~6~,2-thiazinan-2-yl)benzamido]benzoate
Compound characteristics
| Compound ID: | Y043-2293 |
| Compound Name: | methyl 4-[2-chloro-4-(1,1-dioxo-1lambda~6~,2-thiazinan-2-yl)benzamido]benzoate |
| Molecular Weight: | 422.89 |
| Molecular Formula: | C19 H19 Cl N2 O5 S |
| Smiles: | COC(c1ccc(cc1)NC(c1ccc(cc1[Cl])N1CCCCS1(=O)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.9716 |
| logD: | 2.9284 |
| logSw: | -3.8363 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 76.173 |
| InChI Key: | PSUHPGMANICXTC-UHFFFAOYSA-N |