methyl 4-[N-cyclopropyl-N-(4-fluorobenzene-1-sulfonyl)alanyl]-1,3,5-trimethyl-1H-pyrrole-2-carboxylate
Chemical Structure Depiction of
methyl 4-[N-cyclopropyl-N-(4-fluorobenzene-1-sulfonyl)alanyl]-1,3,5-trimethyl-1H-pyrrole-2-carboxylate
methyl 4-[N-cyclopropyl-N-(4-fluorobenzene-1-sulfonyl)alanyl]-1,3,5-trimethyl-1H-pyrrole-2-carboxylate
Compound characteristics
| Compound ID: | V004-8499 |
| Compound Name: | methyl 4-[N-cyclopropyl-N-(4-fluorobenzene-1-sulfonyl)alanyl]-1,3,5-trimethyl-1H-pyrrole-2-carboxylate |
| Molecular Weight: | 436.5 |
| Molecular Formula: | C21 H25 F N2 O5 S |
| Smiles: | CC(C(c1c(C)c(C(=O)OC)n(C)c1C)=O)N(C1CC1)S(c1ccc(cc1)F)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.1626 |
| logD: | 3.1626 |
| logSw: | -3.4717 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 69.188 |
| InChI Key: | MDBKSPXHNSHPTD-AWEZNQCLSA-N |