N-[3-({[4-(dimethylamino)phenyl]methyl}carbamoyl)phenyl]-5-(methoxymethyl)-1,3,4-thiadiazole-2-carboxamide
Chemical Structure Depiction of
N-[3-({[4-(dimethylamino)phenyl]methyl}carbamoyl)phenyl]-5-(methoxymethyl)-1,3,4-thiadiazole-2-carboxamide
N-[3-({[4-(dimethylamino)phenyl]methyl}carbamoyl)phenyl]-5-(methoxymethyl)-1,3,4-thiadiazole-2-carboxamide
Compound characteristics
| Compound ID: | F912-0896 |
| Compound Name: | N-[3-({[4-(dimethylamino)phenyl]methyl}carbamoyl)phenyl]-5-(methoxymethyl)-1,3,4-thiadiazole-2-carboxamide |
| Molecular Weight: | 425.51 |
| Molecular Formula: | C21 H23 N5 O3 S |
| Smiles: | CN(C)c1ccc(CNC(c2cccc(c2)NC(c2nnc(COC)s2)=O)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 2.5081 |
| logD: | 2.4925 |
| logSw: | -2.992 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 82.971 |
| InChI Key: | LBKODNWSFMKCJK-UHFFFAOYSA-N |