1-{4-[4-{1-[(2-chloro-6-fluorophenyl)methyl]-2-methyl-1H-indol-3-yl}-3,6-dihydropyridine-1(2H)-sulfonyl]phenyl}ethan-1-one
Chemical Structure Depiction of
1-{4-[4-{1-[(2-chloro-6-fluorophenyl)methyl]-2-methyl-1H-indol-3-yl}-3,6-dihydropyridine-1(2H)-sulfonyl]phenyl}ethan-1-one
1-{4-[4-{1-[(2-chloro-6-fluorophenyl)methyl]-2-methyl-1H-indol-3-yl}-3,6-dihydropyridine-1(2H)-sulfonyl]phenyl}ethan-1-one
Compound characteristics
| Compound ID: | F588-0624 |
| Compound Name: | 1-{4-[4-{1-[(2-chloro-6-fluorophenyl)methyl]-2-methyl-1H-indol-3-yl}-3,6-dihydropyridine-1(2H)-sulfonyl]phenyl}ethan-1-one |
| Molecular Weight: | 537.05 |
| Molecular Formula: | C29 H26 Cl F N2 O3 S |
| Smiles: | CC(c1ccc(cc1)S(N1CCC(=CC1)c1c2ccccc2n(Cc2c(cccc2[Cl])F)c1C)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 6.147 |
| logD: | 6.147 |
| logSw: | -6.1432 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 46.705 |
| InChI Key: | JGMPYGNOOQHNNQ-UHFFFAOYSA-N |