ethyl 2-(3-bromobenzamido)-4,5,6,7,8,9,10,11,12,13-decahydrocyclododeca[b]thiophene-3-carboxylate
Chemical Structure Depiction of
ethyl 2-(3-bromobenzamido)-4,5,6,7,8,9,10,11,12,13-decahydrocyclododeca[b]thiophene-3-carboxylate
ethyl 2-(3-bromobenzamido)-4,5,6,7,8,9,10,11,12,13-decahydrocyclododeca[b]thiophene-3-carboxylate
Compound characteristics
| Compound ID: | Y500-0215 |
| Compound Name: | ethyl 2-(3-bromobenzamido)-4,5,6,7,8,9,10,11,12,13-decahydrocyclododeca[b]thiophene-3-carboxylate |
| Molecular Weight: | 492.47 |
| Molecular Formula: | C24 H30 Br N O3 S |
| Smiles: | CCOC(c1c2CCCCCCCCCCc2sc1NC(c1cccc(c1)[Br])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 7.9639 |
| logD: | 3.4306 |
| logSw: | -5.6645 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 44.129 |
| InChI Key: | MNUWACXASZLPLJ-UHFFFAOYSA-N |