(azepan-1-yl){5-[4-(2,3-dimethylphenyl)piperazine-1-sulfonyl]thiophen-3-yl}methanone
Chemical Structure Depiction of
(azepan-1-yl){5-[4-(2,3-dimethylphenyl)piperazine-1-sulfonyl]thiophen-3-yl}methanone
(azepan-1-yl){5-[4-(2,3-dimethylphenyl)piperazine-1-sulfonyl]thiophen-3-yl}methanone
Compound characteristics
Compound ID: | F540-1654 |
Compound Name: | (azepan-1-yl){5-[4-(2,3-dimethylphenyl)piperazine-1-sulfonyl]thiophen-3-yl}methanone |
Molecular Weight: | 461.64 |
Molecular Formula: | C23 H31 N3 O3 S2 |
Smiles: | Cc1cccc(c1C)N1CCN(CC1)S(c1cc(cs1)C(N1CCCCCC1)=O)(=O)=O |
Stereo: | ACHIRAL |
logP: | 4.4836 |
logD: | 4.4836 |
logSw: | -4.2797 |
Hydrogen bond acceptors count: | 7 |
Polar surface area: | 52.907 |
InChI Key: | HTIRCSMTNQUGRA-UHFFFAOYSA-N |