6-chloro-N-(3-cyanothiophen-2-yl)-2-oxo-2H-1-benzopyran-3-carboxamide
Chemical Structure Depiction of
6-chloro-N-(3-cyanothiophen-2-yl)-2-oxo-2H-1-benzopyran-3-carboxamide
6-chloro-N-(3-cyanothiophen-2-yl)-2-oxo-2H-1-benzopyran-3-carboxamide
Compound characteristics
| Compound ID: | Y200-1784 |
| Compound Name: | 6-chloro-N-(3-cyanothiophen-2-yl)-2-oxo-2H-1-benzopyran-3-carboxamide |
| Molecular Weight: | 330.75 |
| Molecular Formula: | C15 H7 Cl N2 O3 S |
| Smiles: | C1=C(C(Nc2c(C#N)ccs2)=O)C(=O)Oc2ccc(cc12)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 2.758 |
| logD: | 0.9502 |
| logSw: | -3.8386 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 61.102 |
| InChI Key: | XUDZDNCXNNITDY-UHFFFAOYSA-N |