5-[(4-chlorophenoxy)methyl]-N-(3-{[2-(dimethylamino)ethyl]carbamoyl}phenyl)-1,3,4-thiadiazole-2-carboxamide
Chemical Structure Depiction of
5-[(4-chlorophenoxy)methyl]-N-(3-{[2-(dimethylamino)ethyl]carbamoyl}phenyl)-1,3,4-thiadiazole-2-carboxamide
5-[(4-chlorophenoxy)methyl]-N-(3-{[2-(dimethylamino)ethyl]carbamoyl}phenyl)-1,3,4-thiadiazole-2-carboxamide
Compound characteristics
| Compound ID: | F912-0022 |
| Compound Name: | 5-[(4-chlorophenoxy)methyl]-N-(3-{[2-(dimethylamino)ethyl]carbamoyl}phenyl)-1,3,4-thiadiazole-2-carboxamide |
| Molecular Weight: | 459.95 |
| Molecular Formula: | C21 H22 Cl N5 O3 S |
| Smiles: | CN(C)CCNC(c1cccc(c1)NC(c1nnc(COc2ccc(cc2)[Cl])s1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.0078 |
| logD: | 2.1686 |
| logSw: | -3.7301 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 82.949 |
| InChI Key: | CVCNTCVWEPEWFH-UHFFFAOYSA-N |