methyl 4-[N-(4-fluorobenzene-1-sulfonyl)-N-methylglycyl]-3,5-dimethyl-1H-pyrrole-2-carboxylate
Chemical Structure Depiction of
methyl 4-[N-(4-fluorobenzene-1-sulfonyl)-N-methylglycyl]-3,5-dimethyl-1H-pyrrole-2-carboxylate
methyl 4-[N-(4-fluorobenzene-1-sulfonyl)-N-methylglycyl]-3,5-dimethyl-1H-pyrrole-2-carboxylate
Compound characteristics
| Compound ID: | V009-3177 |
| Compound Name: | methyl 4-[N-(4-fluorobenzene-1-sulfonyl)-N-methylglycyl]-3,5-dimethyl-1H-pyrrole-2-carboxylate |
| Molecular Weight: | 382.41 |
| Molecular Formula: | C17 H19 F N2 O5 S |
| Smiles: | Cc1c(C(CN(C)S(c2ccc(cc2)F)(=O)=O)=O)c(C)[nH]c1C(=O)OC |
| Stereo: | ACHIRAL |
| logP: | 2.2352 |
| logD: | 2.2352 |
| logSw: | -2.8778 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 78.205 |
| InChI Key: | PNMCIDRSBCUSNJ-UHFFFAOYSA-N |