2-[4-(4-chloro-2-methylphenoxy)butanamido]-4,5,6,7,8,9-hexahydrocycloocta[b]thiophene-3-carboxamide
Chemical Structure Depiction of
2-[4-(4-chloro-2-methylphenoxy)butanamido]-4,5,6,7,8,9-hexahydrocycloocta[b]thiophene-3-carboxamide
2-[4-(4-chloro-2-methylphenoxy)butanamido]-4,5,6,7,8,9-hexahydrocycloocta[b]thiophene-3-carboxamide
Compound characteristics
| Compound ID: | Y203-9745 |
| Compound Name: | 2-[4-(4-chloro-2-methylphenoxy)butanamido]-4,5,6,7,8,9-hexahydrocycloocta[b]thiophene-3-carboxamide |
| Molecular Weight: | 434.98 |
| Molecular Formula: | C22 H27 Cl N2 O3 S |
| Smiles: | Cc1cc(ccc1OCCCC(Nc1c(C(N)=O)c2CCCCCCc2s1)=O)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 4.6694 |
| logD: | 4.2251 |
| logSw: | -4.9378 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 64.725 |
| InChI Key: | ARAXHXVCKSWEOP-UHFFFAOYSA-N |