ethyl 1,2,5-trimethyl-4-(4-{[(5-methyl-1H-benzimidazol-2-yl)methyl]carbamoyl}piperidine-1-sulfonyl)-1H-pyrrole-3-carboxylate
Chemical Structure Depiction of
ethyl 1,2,5-trimethyl-4-(4-{[(5-methyl-1H-benzimidazol-2-yl)methyl]carbamoyl}piperidine-1-sulfonyl)-1H-pyrrole-3-carboxylate
ethyl 1,2,5-trimethyl-4-(4-{[(5-methyl-1H-benzimidazol-2-yl)methyl]carbamoyl}piperidine-1-sulfonyl)-1H-pyrrole-3-carboxylate
Compound characteristics
| Compound ID: | G937-0636 |
| Compound Name: | ethyl 1,2,5-trimethyl-4-(4-{[(5-methyl-1H-benzimidazol-2-yl)methyl]carbamoyl}piperidine-1-sulfonyl)-1H-pyrrole-3-carboxylate |
| Molecular Weight: | 515.63 |
| Molecular Formula: | C25 H33 N5 O5 S |
| Smiles: | CCOC(c1c(c(C)n(C)c1C)S(N1CCC(CC1)C(NCc1nc2cc(C)ccc2[nH]1)=O)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.0744 |
| logD: | 2.0742 |
| logSw: | -2.8286 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 100.177 |
| InChI Key: | GBQBFZTUWNQDGC-UHFFFAOYSA-N |