N-[4-({[4-(dimethylamino)phenyl]methyl}carbamoyl)phenyl]-5,6-dihydro-1,4-oxathiine-2-carboxamide
Chemical Structure Depiction of
N-[4-({[4-(dimethylamino)phenyl]methyl}carbamoyl)phenyl]-5,6-dihydro-1,4-oxathiine-2-carboxamide
N-[4-({[4-(dimethylamino)phenyl]methyl}carbamoyl)phenyl]-5,6-dihydro-1,4-oxathiine-2-carboxamide
Compound characteristics
| Compound ID: | G370-0281 |
| Compound Name: | N-[4-({[4-(dimethylamino)phenyl]methyl}carbamoyl)phenyl]-5,6-dihydro-1,4-oxathiine-2-carboxamide |
| Molecular Weight: | 397.49 |
| Molecular Formula: | C21 H23 N3 O3 S |
| Smiles: | CN(C)c1ccc(CNC(c2ccc(cc2)NC(C2=CSCCO2)=O)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 2.4545 |
| logD: | 2.2752 |
| logSw: | -2.8528 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 60.176 |
| InChI Key: | MMUSVYLSSCOWCJ-UHFFFAOYSA-N |