3-chloro-N-[2-oxo-4-(propylamino)-2H-1-benzopyran-3-yl]-1-benzothiophene-2-carboxamide
Chemical Structure Depiction of
3-chloro-N-[2-oxo-4-(propylamino)-2H-1-benzopyran-3-yl]-1-benzothiophene-2-carboxamide
3-chloro-N-[2-oxo-4-(propylamino)-2H-1-benzopyran-3-yl]-1-benzothiophene-2-carboxamide
Compound characteristics
| Compound ID: | C301-6883 |
| Compound Name: | 3-chloro-N-[2-oxo-4-(propylamino)-2H-1-benzopyran-3-yl]-1-benzothiophene-2-carboxamide |
| Molecular Weight: | 412.89 |
| Molecular Formula: | C21 H17 Cl N2 O3 S |
| Smiles: | CCCNC1=C(C(=O)Oc2ccccc12)NC(c1c(c2ccccc2s1)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 4.4271 |
| logD: | 3.7462 |
| logSw: | -4.7602 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 55.744 |
| InChI Key: | SWMIUAQJNGHDQS-UHFFFAOYSA-N |