2-(azepane-1-carbonyl)-8-methyl-4H-thieno[3,2-c][1]benzopyran-4-one
Chemical Structure Depiction of
2-(azepane-1-carbonyl)-8-methyl-4H-thieno[3,2-c][1]benzopyran-4-one
2-(azepane-1-carbonyl)-8-methyl-4H-thieno[3,2-c][1]benzopyran-4-one
Compound characteristics
| Compound ID: | C593-1080 |
| Compound Name: | 2-(azepane-1-carbonyl)-8-methyl-4H-thieno[3,2-c][1]benzopyran-4-one |
| Molecular Weight: | 341.43 |
| Molecular Formula: | C19 H19 N O3 S |
| Smiles: | Cc1ccc2c(c1)c1c(cc(C(N3CCCCCC3)=O)s1)C(=O)O2 |
| Stereo: | ACHIRAL |
| logP: | 4.4969 |
| logD: | 4.4969 |
| logSw: | -4.3048 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 38.886 |
| InChI Key: | JPQWFTYBBLNOQV-UHFFFAOYSA-N |