6-chloro-7-methyl-4-oxo-N-[2-(pyrrolidin-1-yl)-2-(thiophen-2-yl)ethyl]-4H-1-benzopyran-2-carboxamide
Chemical Structure Depiction of
6-chloro-7-methyl-4-oxo-N-[2-(pyrrolidin-1-yl)-2-(thiophen-2-yl)ethyl]-4H-1-benzopyran-2-carboxamide
6-chloro-7-methyl-4-oxo-N-[2-(pyrrolidin-1-yl)-2-(thiophen-2-yl)ethyl]-4H-1-benzopyran-2-carboxamide
Compound characteristics
| Compound ID: | D491-2886 |
| Compound Name: | 6-chloro-7-methyl-4-oxo-N-[2-(pyrrolidin-1-yl)-2-(thiophen-2-yl)ethyl]-4H-1-benzopyran-2-carboxamide |
| Molecular Weight: | 416.93 |
| Molecular Formula: | C21 H21 Cl N2 O3 S |
| Smiles: | [H]N(CC(c1cccs1)N1CCCC1)C(C1=CC(c2cc(c(C)cc2O1)[Cl])=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.4736 |
| logD: | 3.7693 |
| logSw: | -4.6915 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 50.844 |
| InChI Key: | SMWISKBATHJZEW-INIZCTEOSA-N |