N-(4-{[3-(3,4-dihydroisoquinolin-2(1H)-yl)propyl]carbamoyl}phenyl)-5-(methoxymethyl)-1,3,4-thiadiazole-2-carboxamide
Chemical Structure Depiction of
N-(4-{[3-(3,4-dihydroisoquinolin-2(1H)-yl)propyl]carbamoyl}phenyl)-5-(methoxymethyl)-1,3,4-thiadiazole-2-carboxamide
N-(4-{[3-(3,4-dihydroisoquinolin-2(1H)-yl)propyl]carbamoyl}phenyl)-5-(methoxymethyl)-1,3,4-thiadiazole-2-carboxamide
Compound characteristics
| Compound ID: | F913-0998 |
| Compound Name: | N-(4-{[3-(3,4-dihydroisoquinolin-2(1H)-yl)propyl]carbamoyl}phenyl)-5-(methoxymethyl)-1,3,4-thiadiazole-2-carboxamide |
| Molecular Weight: | 465.57 |
| Molecular Formula: | C24 H27 N5 O3 S |
| Smiles: | COCc1nnc(C(Nc2ccc(cc2)C(NCCCN2CCc3ccccc3C2)=O)=O)s1 |
| Stereo: | ACHIRAL |
| logP: | 2.3692 |
| logD: | 1.2193 |
| logSw: | -2.832 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 83.652 |
| InChI Key: | JKCZCOMQZFRENQ-UHFFFAOYSA-N |