N-(5-{[(3-methoxyphenyl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)-3-methylbutanamide
Chemical Structure Depiction of
N-(5-{[(3-methoxyphenyl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)-3-methylbutanamide
N-(5-{[(3-methoxyphenyl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)-3-methylbutanamide
Compound characteristics
| Compound ID: | V011-6499 |
| Compound Name: | N-(5-{[(3-methoxyphenyl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)-3-methylbutanamide |
| Molecular Weight: | 337.46 |
| Molecular Formula: | C15 H19 N3 O2 S2 |
| Smiles: | CC(C)CC(Nc1nnc(SCc2cccc(c2)OC)s1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.2435 |
| logD: | 4.2399 |
| logSw: | -4.3276 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 53.566 |
| InChI Key: | HKDAPWXFOVKFCZ-UHFFFAOYSA-N |