5-(azepan-1-yl)-N-[(5-bromo-2-methoxyphenyl)methyl]-4-phenylthiophene-2-carboxamide
Chemical Structure Depiction of
5-(azepan-1-yl)-N-[(5-bromo-2-methoxyphenyl)methyl]-4-phenylthiophene-2-carboxamide
5-(azepan-1-yl)-N-[(5-bromo-2-methoxyphenyl)methyl]-4-phenylthiophene-2-carboxamide
Compound characteristics
| Compound ID: | G122-1130 |
| Compound Name: | 5-(azepan-1-yl)-N-[(5-bromo-2-methoxyphenyl)methyl]-4-phenylthiophene-2-carboxamide |
| Molecular Weight: | 499.47 |
| Molecular Formula: | C25 H27 Br N2 O2 S |
| Smiles: | COc1ccc(cc1CNC(c1cc(c2ccccc2)c(N2CCCCCC2)s1)=O)[Br] |
| Stereo: | ACHIRAL |
| logP: | 6.8279 |
| logD: | 6.8279 |
| logSw: | -5.6289 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 36.863 |
| InChI Key: | LRBSDTPZMJQMQJ-UHFFFAOYSA-N |