N-(5-{[(3-methoxyphenyl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)cyclopropanecarboxamide
Chemical Structure Depiction of
N-(5-{[(3-methoxyphenyl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)cyclopropanecarboxamide
N-(5-{[(3-methoxyphenyl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)cyclopropanecarboxamide
Compound characteristics
| Compound ID: | V021-4093 |
| Compound Name: | N-(5-{[(3-methoxyphenyl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)cyclopropanecarboxamide |
| Molecular Weight: | 321.42 |
| Molecular Formula: | C14 H15 N3 O2 S2 |
| Smiles: | COc1cccc(CSc2nnc(NC(C3CC3)=O)s2)c1 |
| Stereo: | ACHIRAL |
| logP: | 3.8066 |
| logD: | 3.8051 |
| logSw: | -4.0083 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.031 |
| InChI Key: | GPERWSZJNQONSZ-UHFFFAOYSA-N |