3-chloro-N-[4-(cyclohexylamino)-2-oxo-2H-1-benzopyran-3-yl]-1-benzothiophene-2-carboxamide
Chemical Structure Depiction of
3-chloro-N-[4-(cyclohexylamino)-2-oxo-2H-1-benzopyran-3-yl]-1-benzothiophene-2-carboxamide
3-chloro-N-[4-(cyclohexylamino)-2-oxo-2H-1-benzopyran-3-yl]-1-benzothiophene-2-carboxamide
Compound characteristics
| Compound ID: | C301-7251 |
| Compound Name: | 3-chloro-N-[4-(cyclohexylamino)-2-oxo-2H-1-benzopyran-3-yl]-1-benzothiophene-2-carboxamide |
| Molecular Weight: | 452.96 |
| Molecular Formula: | C24 H21 Cl N2 O3 S |
| Smiles: | C1CCC(CC1)NC1=C(C(=O)Oc2ccccc12)NC(c1c(c2ccccc2s1)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 5.6107 |
| logD: | 4.9461 |
| logSw: | -5.9676 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 55.356 |
| InChI Key: | YKQXQDFWQHNIOS-UHFFFAOYSA-N |