N-(3-{[(furan-2-yl)methyl]carbamoyl}-4,5,6,7,8,9-hexahydrocycloocta[b]thiophen-2-yl)-3,5-dimethyl-1,2-oxazole-4-carboxamide
Chemical Structure Depiction of
N-(3-{[(furan-2-yl)methyl]carbamoyl}-4,5,6,7,8,9-hexahydrocycloocta[b]thiophen-2-yl)-3,5-dimethyl-1,2-oxazole-4-carboxamide
N-(3-{[(furan-2-yl)methyl]carbamoyl}-4,5,6,7,8,9-hexahydrocycloocta[b]thiophen-2-yl)-3,5-dimethyl-1,2-oxazole-4-carboxamide
Compound characteristics
| Compound ID: | Y205-8412 |
| Compound Name: | N-(3-{[(furan-2-yl)methyl]carbamoyl}-4,5,6,7,8,9-hexahydrocycloocta[b]thiophen-2-yl)-3,5-dimethyl-1,2-oxazole-4-carboxamide |
| Molecular Weight: | 427.52 |
| Molecular Formula: | C22 H25 N3 O4 S |
| Smiles: | Cc1c(C(Nc2c(C(NCc3ccco3)=O)c3CCCCCCc3s2)=O)c(C)on1 |
| Stereo: | ACHIRAL |
| logP: | 4.4044 |
| logD: | 1.799 |
| logSw: | -4.3929 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 77.576 |
| InChI Key: | XLWUWGNHYRKYFT-UHFFFAOYSA-N |