{2-[4-(azepane-1-sulfonyl)-1-methyl-1H-pyrrol-2-yl]-4-methyl-1,3-thiazol-5-yl}(pyrrolidin-1-yl)methanone
Chemical Structure Depiction of
{2-[4-(azepane-1-sulfonyl)-1-methyl-1H-pyrrol-2-yl]-4-methyl-1,3-thiazol-5-yl}(pyrrolidin-1-yl)methanone
{2-[4-(azepane-1-sulfonyl)-1-methyl-1H-pyrrol-2-yl]-4-methyl-1,3-thiazol-5-yl}(pyrrolidin-1-yl)methanone
Compound characteristics
| Compound ID: | M330-0061 |
| Compound Name: | {2-[4-(azepane-1-sulfonyl)-1-methyl-1H-pyrrol-2-yl]-4-methyl-1,3-thiazol-5-yl}(pyrrolidin-1-yl)methanone |
| Molecular Weight: | 436.59 |
| Molecular Formula: | C20 H28 N4 O3 S2 |
| Smiles: | Cc1c(C(N2CCCC2)=O)sc(c2cc(cn2C)S(N2CCCCCC2)(=O)=O)n1 |
| Stereo: | ACHIRAL |
| logP: | 3.1338 |
| logD: | 3.1338 |
| logSw: | -3.2653 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 61.915 |
| InChI Key: | IVAWMPMOCAGWFK-UHFFFAOYSA-N |