1-(2,3,4,5,6-pentamethylbenzene-1-sulfonyl)-4-{[4-(1H-pyrrol-1-yl)phenyl]methyl}piperidine
Chemical Structure Depiction of
1-(2,3,4,5,6-pentamethylbenzene-1-sulfonyl)-4-{[4-(1H-pyrrol-1-yl)phenyl]methyl}piperidine
1-(2,3,4,5,6-pentamethylbenzene-1-sulfonyl)-4-{[4-(1H-pyrrol-1-yl)phenyl]methyl}piperidine
Compound characteristics
| Compound ID: | V001-6337 |
| Compound Name: | 1-(2,3,4,5,6-pentamethylbenzene-1-sulfonyl)-4-{[4-(1H-pyrrol-1-yl)phenyl]methyl}piperidine |
| Molecular Weight: | 450.64 |
| Molecular Formula: | C27 H34 N2 O2 S |
| Smiles: | Cc1c(C)c(C)c(c(C)c1C)S(N1CCC(CC1)Cc1ccc(cc1)n1cccc1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 7.2885 |
| logD: | 7.2885 |
| logSw: | -5.8756 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 35.664 |
| InChI Key: | KFAPRDBHOVQMBC-UHFFFAOYSA-N |