(4-bromo-5-ethylthiophen-2-yl)(4-methyl-1,4-diazepan-1-yl)methanone
Chemical Structure Depiction of
(4-bromo-5-ethylthiophen-2-yl)(4-methyl-1,4-diazepan-1-yl)methanone
(4-bromo-5-ethylthiophen-2-yl)(4-methyl-1,4-diazepan-1-yl)methanone
Compound characteristics
| Compound ID: | Y206-5994 |
| Compound Name: | (4-bromo-5-ethylthiophen-2-yl)(4-methyl-1,4-diazepan-1-yl)methanone |
| Molecular Weight: | 331.27 |
| Molecular Formula: | C13 H19 Br N2 O S |
| Smiles: | CCc1c(cc(C(N2CCCN(C)CC2)=O)s1)[Br] |
| Stereo: | ACHIRAL |
| logP: | 2.9053 |
| logD: | 2.0009 |
| logSw: | -3.1234 |
| Hydrogen bond acceptors count: | 3 |
| Polar surface area: | 21.7127 |
| InChI Key: | BCWNVPJVVCNIAJ-UHFFFAOYSA-N |