6-chloro-4-oxo-N-(3-{[(oxolan-2-yl)methyl]carbamoyl}-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)-4H-1-benzopyran-2-carboxamide
Chemical Structure Depiction of
6-chloro-4-oxo-N-(3-{[(oxolan-2-yl)methyl]carbamoyl}-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)-4H-1-benzopyran-2-carboxamide
6-chloro-4-oxo-N-(3-{[(oxolan-2-yl)methyl]carbamoyl}-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)-4H-1-benzopyran-2-carboxamide
Compound characteristics
| Compound ID: | D103-1264 |
| Compound Name: | 6-chloro-4-oxo-N-(3-{[(oxolan-2-yl)methyl]carbamoyl}-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)-4H-1-benzopyran-2-carboxamide |
| Molecular Weight: | 472.95 |
| Molecular Formula: | C23 H21 Cl N2 O5 S |
| Smiles: | [H]N(C(C1=CC(c2cc(ccc2O1)[Cl])=O)=O)c1c(C(NCC2CCCO2)=O)c2CCCc2s1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.5596 |
| logD: | 1.1035 |
| logSw: | -4.5035 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 78.297 |
| InChI Key: | CQMDVUDZQSPWTR-CYBMUJFWSA-N |