N-[(5-{[2-(4-bromoanilino)-2-oxoethyl]sulfanyl}-1,3,4-oxadiazol-2-yl)methyl]thiophene-2-carboxamide
Chemical Structure Depiction of
N-[(5-{[2-(4-bromoanilino)-2-oxoethyl]sulfanyl}-1,3,4-oxadiazol-2-yl)methyl]thiophene-2-carboxamide
N-[(5-{[2-(4-bromoanilino)-2-oxoethyl]sulfanyl}-1,3,4-oxadiazol-2-yl)methyl]thiophene-2-carboxamide
Compound characteristics
| Compound ID: | C328-0336 |
| Compound Name: | N-[(5-{[2-(4-bromoanilino)-2-oxoethyl]sulfanyl}-1,3,4-oxadiazol-2-yl)methyl]thiophene-2-carboxamide |
| Molecular Weight: | 453.33 |
| Molecular Formula: | C16 H13 Br N4 O3 S2 |
| Smiles: | C(c1nnc(o1)SCC(Nc1ccc(cc1)[Br])=O)NC(c1cccs1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.8142 |
| logD: | 2.8141 |
| logSw: | -3.3573 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 78.582 |
| InChI Key: | CVNWKQZXLNSYEQ-UHFFFAOYSA-N |