4-({butyl[(thiophen-2-yl)methyl]amino}methyl)-6-ethoxy-2H-1-benzopyran-2-one
Chemical Structure Depiction of
4-({butyl[(thiophen-2-yl)methyl]amino}methyl)-6-ethoxy-2H-1-benzopyran-2-one
4-({butyl[(thiophen-2-yl)methyl]amino}methyl)-6-ethoxy-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | D154-0133 |
| Compound Name: | 4-({butyl[(thiophen-2-yl)methyl]amino}methyl)-6-ethoxy-2H-1-benzopyran-2-one |
| Molecular Weight: | 371.5 |
| Molecular Formula: | C21 H25 N O3 S |
| Smiles: | CCCCN(CC1=CC(=O)Oc2ccc(cc12)OCC)Cc1cccs1 |
| Stereo: | ACHIRAL |
| logP: | 4.5836 |
| logD: | 4.5393 |
| logSw: | -4.2518 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 32.478 |
| InChI Key: | XMUSQFMCWOZELC-UHFFFAOYSA-N |