3-cyclopentyl-N-(5-{[(3-methoxyphenyl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)propanamide
Chemical Structure Depiction of
3-cyclopentyl-N-(5-{[(3-methoxyphenyl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)propanamide
3-cyclopentyl-N-(5-{[(3-methoxyphenyl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)propanamide
Compound characteristics
| Compound ID: | V015-0545 |
| Compound Name: | 3-cyclopentyl-N-(5-{[(3-methoxyphenyl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)propanamide |
| Molecular Weight: | 377.53 |
| Molecular Formula: | C18 H23 N3 O2 S2 |
| Smiles: | COc1cccc(CSc2nnc(NC(CCC3CCCC3)=O)s2)c1 |
| Stereo: | ACHIRAL |
| logP: | 4.9206 |
| logD: | 4.9182 |
| logSw: | -4.6751 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 53.853 |
| InChI Key: | RHTNYFMCBQUPTK-UHFFFAOYSA-N |