4-butyl-N-(3-{[5-(3-methylphenyl)-1,3,4-thiadiazol-2-yl]amino}-3-oxopropyl)benzamide
Chemical Structure Depiction of
4-butyl-N-(3-{[5-(3-methylphenyl)-1,3,4-thiadiazol-2-yl]amino}-3-oxopropyl)benzamide
4-butyl-N-(3-{[5-(3-methylphenyl)-1,3,4-thiadiazol-2-yl]amino}-3-oxopropyl)benzamide
Compound characteristics
| Compound ID: | V009-5259 |
| Compound Name: | 4-butyl-N-(3-{[5-(3-methylphenyl)-1,3,4-thiadiazol-2-yl]amino}-3-oxopropyl)benzamide |
| Molecular Weight: | 422.55 |
| Molecular Formula: | C23 H26 N4 O2 S |
| Smiles: | CCCCc1ccc(cc1)C(NCCC(Nc1nnc(c2cccc(C)c2)s1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.1107 |
| logD: | 5.1103 |
| logSw: | -4.8694 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 70.916 |
| InChI Key: | XRWYDFXUAAERHA-UHFFFAOYSA-N |