N-[(5-{[2-(3-chloro-4-methylanilino)-2-oxoethyl]sulfanyl}-1,3,4-oxadiazol-2-yl)methyl]thiophene-2-carboxamide
Chemical Structure Depiction of
N-[(5-{[2-(3-chloro-4-methylanilino)-2-oxoethyl]sulfanyl}-1,3,4-oxadiazol-2-yl)methyl]thiophene-2-carboxamide
N-[(5-{[2-(3-chloro-4-methylanilino)-2-oxoethyl]sulfanyl}-1,3,4-oxadiazol-2-yl)methyl]thiophene-2-carboxamide
Compound characteristics
| Compound ID: | C328-0363 |
| Compound Name: | N-[(5-{[2-(3-chloro-4-methylanilino)-2-oxoethyl]sulfanyl}-1,3,4-oxadiazol-2-yl)methyl]thiophene-2-carboxamide |
| Molecular Weight: | 422.91 |
| Molecular Formula: | C17 H15 Cl N4 O3 S2 |
| Smiles: | Cc1ccc(cc1[Cl])NC(CSc1nnc(CNC(c2cccs2)=O)o1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.3705 |
| logD: | 3.3703 |
| logSw: | -3.5452 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 78.582 |
| InChI Key: | BVTUVYNLYPDHTF-UHFFFAOYSA-N |