{2-[1,5-dimethyl-4-(4-methylpiperazine-1-sulfonyl)-1H-pyrrol-2-yl]-4-methyl-1,3-thiazol-5-yl}(pyrrolidin-1-yl)methanone
Chemical Structure Depiction of
{2-[1,5-dimethyl-4-(4-methylpiperazine-1-sulfonyl)-1H-pyrrol-2-yl]-4-methyl-1,3-thiazol-5-yl}(pyrrolidin-1-yl)methanone
{2-[1,5-dimethyl-4-(4-methylpiperazine-1-sulfonyl)-1H-pyrrol-2-yl]-4-methyl-1,3-thiazol-5-yl}(pyrrolidin-1-yl)methanone
Compound characteristics
| Compound ID: | L507-2077 |
| Compound Name: | {2-[1,5-dimethyl-4-(4-methylpiperazine-1-sulfonyl)-1H-pyrrol-2-yl]-4-methyl-1,3-thiazol-5-yl}(pyrrolidin-1-yl)methanone |
| Molecular Weight: | 451.61 |
| Molecular Formula: | C20 H29 N5 O3 S2 |
| Smiles: | Cc1c(C(N2CCCC2)=O)sc(c2cc(c(C)n2C)S(N2CCN(C)CC2)(=O)=O)n1 |
| Stereo: | ACHIRAL |
| logP: | 1.7207 |
| logD: | 1.6581 |
| logSw: | -2.1817 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 64.784 |
| InChI Key: | ODVFHZGDBSXLRD-UHFFFAOYSA-N |