2-methoxy-5-{[2-(3-methylthiophen-2-yl)azepan-1-yl]methyl}phenol
Chemical Structure Depiction of
2-methoxy-5-{[2-(3-methylthiophen-2-yl)azepan-1-yl]methyl}phenol
2-methoxy-5-{[2-(3-methylthiophen-2-yl)azepan-1-yl]methyl}phenol
Compound characteristics
| Compound ID: | J006-1401 |
| Compound Name: | 2-methoxy-5-{[2-(3-methylthiophen-2-yl)azepan-1-yl]methyl}phenol |
| Molecular Weight: | 331.48 |
| Molecular Formula: | C19 H25 N O2 S |
| Smiles: | Cc1ccsc1C1CCCCCN1Cc1ccc(c(c1)O)OC |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.2624 |
| logD: | 3.6049 |
| logSw: | -3.9127 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 29.087 |
| InChI Key: | ZPDAINITPUUDCR-INIZCTEOSA-N |