N-[(5-{[2-(3,5-dimethylanilino)-2-oxoethyl]sulfanyl}-1,3,4-oxadiazol-2-yl)methyl]thiophene-2-carboxamide
Chemical Structure Depiction of
N-[(5-{[2-(3,5-dimethylanilino)-2-oxoethyl]sulfanyl}-1,3,4-oxadiazol-2-yl)methyl]thiophene-2-carboxamide
N-[(5-{[2-(3,5-dimethylanilino)-2-oxoethyl]sulfanyl}-1,3,4-oxadiazol-2-yl)methyl]thiophene-2-carboxamide
Compound characteristics
Compound ID: | C328-0343 |
Compound Name: | N-[(5-{[2-(3,5-dimethylanilino)-2-oxoethyl]sulfanyl}-1,3,4-oxadiazol-2-yl)methyl]thiophene-2-carboxamide |
Molecular Weight: | 402.49 |
Molecular Formula: | C18 H18 N4 O3 S2 |
Smiles: | Cc1cc(C)cc(c1)NC(CSc1nnc(CNC(c2cccs2)=O)o1)=O |
Stereo: | ACHIRAL |
logP: | 2.6733 |
logD: | 2.6733 |
logSw: | -2.9676 |
Hydrogen bond acceptors count: | 8 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 78.582 |
InChI Key: | BUQMDYIRPQYSQF-UHFFFAOYSA-N |