N-[1-(2-methoxyethyl)-4,5-dimethyl-3-(4-methylbenzene-1-sulfonyl)-1H-pyrrol-2-yl]thiophene-2-carboxamide
Chemical Structure Depiction of
N-[1-(2-methoxyethyl)-4,5-dimethyl-3-(4-methylbenzene-1-sulfonyl)-1H-pyrrol-2-yl]thiophene-2-carboxamide
N-[1-(2-methoxyethyl)-4,5-dimethyl-3-(4-methylbenzene-1-sulfonyl)-1H-pyrrol-2-yl]thiophene-2-carboxamide
Compound characteristics
Compound ID: | D715-2074 |
Compound Name: | N-[1-(2-methoxyethyl)-4,5-dimethyl-3-(4-methylbenzene-1-sulfonyl)-1H-pyrrol-2-yl]thiophene-2-carboxamide |
Molecular Weight: | 432.56 |
Molecular Formula: | C21 H24 N2 O4 S2 |
Smiles: | Cc1ccc(cc1)S(c1c(C)c(C)n(CCOC)c1NC(c1cccs1)=O)(=O)=O |
Stereo: | ACHIRAL |
logP: | 3.7779 |
logD: | 3.7651 |
logSw: | -3.8678 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 63.811 |
InChI Key: | POWCMYCJXVORIT-UHFFFAOYSA-N |