N-[4,5-dimethyl-3-(4-methylbenzene-1-sulfonyl)-1-(propan-2-yl)-1H-pyrrol-2-yl]thiophene-2-carboxamide
Chemical Structure Depiction of
N-[4,5-dimethyl-3-(4-methylbenzene-1-sulfonyl)-1-(propan-2-yl)-1H-pyrrol-2-yl]thiophene-2-carboxamide
N-[4,5-dimethyl-3-(4-methylbenzene-1-sulfonyl)-1-(propan-2-yl)-1H-pyrrol-2-yl]thiophene-2-carboxamide
Compound characteristics
| Compound ID: | D715-2243 |
| Compound Name: | N-[4,5-dimethyl-3-(4-methylbenzene-1-sulfonyl)-1-(propan-2-yl)-1H-pyrrol-2-yl]thiophene-2-carboxamide |
| Molecular Weight: | 416.56 |
| Molecular Formula: | C21 H24 N2 O3 S2 |
| Smiles: | CC(C)n1c(C)c(C)c(c1NC(c1cccs1)=O)S(c1ccc(C)cc1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.4668 |
| logD: | 4.4622 |
| logSw: | -4.1775 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.565 |
| InChI Key: | XDEHYQZSBBVTMV-UHFFFAOYSA-N |