5-(azepane-1-sulfonyl)-1-[(2,5-dimethylphenyl)methyl]pyridin-2(1H)-one
Chemical Structure Depiction of
5-(azepane-1-sulfonyl)-1-[(2,5-dimethylphenyl)methyl]pyridin-2(1H)-one
5-(azepane-1-sulfonyl)-1-[(2,5-dimethylphenyl)methyl]pyridin-2(1H)-one
Compound characteristics
| Compound ID: | P511-0446 |
| Compound Name: | 5-(azepane-1-sulfonyl)-1-[(2,5-dimethylphenyl)methyl]pyridin-2(1H)-one |
| Molecular Weight: | 374.5 |
| Molecular Formula: | C20 H26 N2 O3 S |
| Smiles: | Cc1ccc(C)c(CN2C=C(C=CC2=O)S(N2CCCCCC2)(=O)=O)c1 |
| Stereo: | ACHIRAL |
| logP: | 3.5522 |
| logD: | 3.5522 |
| logSw: | -3.5927 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 48.792 |
| InChI Key: | RLBKALVRJODSNZ-UHFFFAOYSA-N |