5-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-(3-{[(furan-2-yl)methyl]carbamoyl}-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)-1,2-oxazole-3-carboxamide
Chemical Structure Depiction of
5-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-(3-{[(furan-2-yl)methyl]carbamoyl}-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)-1,2-oxazole-3-carboxamide
5-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-(3-{[(furan-2-yl)methyl]carbamoyl}-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)-1,2-oxazole-3-carboxamide
Compound characteristics
Compound ID: | D337-1343 |
Compound Name: | 5-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-(3-{[(furan-2-yl)methyl]carbamoyl}-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)-1,2-oxazole-3-carboxamide |
Molecular Weight: | 491.52 |
Molecular Formula: | C25 H21 N3 O6 S |
Smiles: | [H]N(C(c1cc(c2ccc3c(c2)OCCO3)on1)=O)c1c(C(NCc2ccco2)=O)c2CCCc2s1 |
Stereo: | ACHIRAL |
logP: | 3.6989 |
logD: | 3.0576 |
logSw: | -4.321 |
Hydrogen bond acceptors count: | 9 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 92.931 |
InChI Key: | UHKAXSIXLSBUIE-UHFFFAOYSA-N |