5-[(2-{[2-(cyclohex-1-en-1-yl)ethyl]amino}-2-oxoethoxy)methyl]-N-(4-methylphenyl)-1,3,4-thiadiazole-2-carboxamide
Chemical Structure Depiction of
5-[(2-{[2-(cyclohex-1-en-1-yl)ethyl]amino}-2-oxoethoxy)methyl]-N-(4-methylphenyl)-1,3,4-thiadiazole-2-carboxamide
5-[(2-{[2-(cyclohex-1-en-1-yl)ethyl]amino}-2-oxoethoxy)methyl]-N-(4-methylphenyl)-1,3,4-thiadiazole-2-carboxamide
Compound characteristics
| Compound ID: | F500-0302 |
| Compound Name: | 5-[(2-{[2-(cyclohex-1-en-1-yl)ethyl]amino}-2-oxoethoxy)methyl]-N-(4-methylphenyl)-1,3,4-thiadiazole-2-carboxamide |
| Molecular Weight: | 414.53 |
| Molecular Formula: | C21 H26 N4 O3 S |
| Smiles: | Cc1ccc(cc1)NC(c1nnc(COCC(NCCC2CCCCC=2)=O)s1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.776 |
| logD: | 2.7759 |
| logSw: | -3.322 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 79.997 |
| InChI Key: | OFAIIUIEIPLNIB-UHFFFAOYSA-N |