1-{6-[4-(3-chlorophenyl)piperazine-1-sulfonyl]-3,4-dihydroquinolin-1(2H)-yl}ethan-1-one
Chemical Structure Depiction of
1-{6-[4-(3-chlorophenyl)piperazine-1-sulfonyl]-3,4-dihydroquinolin-1(2H)-yl}ethan-1-one
1-{6-[4-(3-chlorophenyl)piperazine-1-sulfonyl]-3,4-dihydroquinolin-1(2H)-yl}ethan-1-one
Compound characteristics
| Compound ID: | C444-1837 |
| Compound Name: | 1-{6-[4-(3-chlorophenyl)piperazine-1-sulfonyl]-3,4-dihydroquinolin-1(2H)-yl}ethan-1-one |
| Molecular Weight: | 433.96 |
| Molecular Formula: | C21 H24 Cl N3 O3 S |
| Smiles: | CC(N1CCCc2cc(ccc12)S(N1CCN(CC1)c1cccc(c1)[Cl])(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.3138 |
| logD: | 3.3138 |
| logSw: | -3.6917 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 51.262 |
| InChI Key: | ROCLEPFCNKZNHD-UHFFFAOYSA-N |