ethyl 2-{[5-(3-bromobenzamido)-1,3,4-thiadiazol-2-yl]sulfanyl}propanoate
Chemical Structure Depiction of
ethyl 2-{[5-(3-bromobenzamido)-1,3,4-thiadiazol-2-yl]sulfanyl}propanoate
ethyl 2-{[5-(3-bromobenzamido)-1,3,4-thiadiazol-2-yl]sulfanyl}propanoate
Compound characteristics
| Compound ID: | V013-1063 |
| Compound Name: | ethyl 2-{[5-(3-bromobenzamido)-1,3,4-thiadiazol-2-yl]sulfanyl}propanoate |
| Molecular Weight: | 416.31 |
| Molecular Formula: | C14 H14 Br N3 O3 S2 |
| Salt: | not_available |
| Smiles: | CCOC(C(C)Sc1nnc(NC(c2cccc(c2)[Br])=O)s1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.6198 |
| logD: | 4.3485 |
| logSw: | -4.2773 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 66.989 |
| InChI Key: | SLRODMHQKSQPKB-QMMMGPOBSA-N |